USER MOD reduce.3.24.130724 H: found=0, std=0, add=1144, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1143 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 115 CYS SG : rot 93:sc= 0.131 USER MOD Set 1.2: A 119 THR OG1 : rot -124:sc= -0.855 USER MOD Set 2.1: A 62 CYS SG : rot 167:sc= -0.0441 USER MOD Set 2.2: A 142 MET CE :methyl -168:sc= 0 (180deg=-0.298) USER MOD Set 3.1: A 54 HIS : no HD1:sc= -0.11 X(o=-0.11,f=-0.036) USER MOD Set 3.2: A 63 GLN : amide:sc= 0 X(o=-0.11,f=-0.036) USER MOD Single : A 3 ASN : amide:sc= -1.92 K(o=-1.9,f=-11!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -151:sc= -3.12 USER MOD Single : A 28 LYS NZ :NH3+ -130:sc= -0.122 (180deg=-3.59!) USER MOD Single : A 31 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0308) USER MOD Single : A 32 THR OG1 : rot -160:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -1.28 K(o=-1.3,f=-4.5!) USER MOD Single : A 40 SER OG : rot 180:sc= -0.379 USER MOD Single : A 41 THR OG1 : rot -70:sc= -0.71 USER MOD Single : A 44 LYS NZ :NH3+ 172:sc= 1.01 (180deg=0.825) USER MOD Single : A 48 TYR OH : rot 89:sc= 1.05 USER MOD Single : A 49 LYS NZ :NH3+ -130:sc= 0.851 (180deg=-2.43!) USER MOD Single : A 51 SER OG : rot -160:sc= -0.278 USER MOD Single : A 52 CYS SG : rot 180:sc= 0 USER MOD Single : A 61 MET CE :methyl -110:sc= -0.449 (180deg=-2.65!) USER MOD Single : A 79 TYR OH : rot 120:sc=-0.00217 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= -1.43 K(o=-1.4,f=-8.5!) USER MOD Single : A 91 LYS NZ :NH3+ 169:sc= -0.0317 (180deg=-0.236) USER MOD Single : A 92 HIS : no HD1:sc= -0.143 K(o=-0.14,f=-3.6!) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 140:sc= -1.65 USER MOD Single : A 100 MET CE :methyl -156:sc= -1.82 (180deg=-3.17!) USER MOD Single : A 102 ASN : amide:sc= -3.84 X(o=-3.8,f=-3.7!) USER MOD Single : A 106 ASN : amide:sc= -2.44! C(o=-2.4!,f=-2.9!) USER MOD Single : A 107 THR OG1 : rot -48:sc= -0.178 USER MOD Single : A 108 ASN : amide:sc= -1.12 K(o=-1.1,f=-3.9!) USER MOD Single : A 110 SER OG : rot -53:sc= 1.08 USER MOD Single : A 111 GLN : amide:sc= -0.393 X(o=-0.39,f=-0.32) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0596) USER MOD Single : A 125 LYS NZ :NH3+ 158:sc= -0.0192 (180deg=-0.158) USER MOD Single : A 126 HIS : no HE2:sc= -2.49 K(o=-2.5,f=-5.5!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl -175:sc= 0 (180deg=-0.000527) USER MOD Single : A 137 ASN : amide:sc= -0.309 X(o=-0.31,f=-0.012) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 149 ASN :FLIP amide:sc= -0.336 F(o=-1.2,f=-0.34) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 THR OG1 : rot 102:sc= 0.807 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 155:sc= 1.48 (180deg=1.33) USER MOD Single : A 155 LYS NZ :NH3+ 169:sc=-0.00702 (180deg=-0.129) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 161 CYS SG : rot 180:sc= -1.16 USER MOD Single : A 163 GLN : amide:sc= -2.44 K(o=-2.4,f=-11!) USER MOD ----------------------------------------------------------------- ATOM 18 N VAL A 2 3.547 2.224 -1.628 1.00 52.23 N ATOM 19 CA VAL A 2 4.168 3.515 -1.360 1.00 3.54 C ATOM 20 C VAL A 2 3.118 4.610 -1.206 1.00 71.33 C ATOM 21 O VAL A 2 2.178 4.697 -1.996 1.00 4.14 O ATOM 22 CB VAL A 2 5.147 3.912 -2.481 1.00 74.23 C ATOM 23 CG1 VAL A 2 5.518 5.383 -2.371 1.00 72.23 C ATOM 24 CG2 VAL A 2 6.389 3.035 -2.438 1.00 42.22 C ATOM 0 HA VAL A 2 4.720 3.411 -0.426 1.00 3.54 H new ATOM 0 HB VAL A 2 4.655 3.758 -3.441 1.00 74.23 H new ATOM 0 HG11 VAL A 2 6.210 5.644 -3.171 1.00 72.23 H new ATOM 0 HG12 VAL A 2 4.618 5.992 -2.456 1.00 72.23 H new ATOM 0 HG13 VAL A 2 5.992 5.568 -1.407 1.00 72.23 H new ATOM 0 HG21 VAL A 2 7.070 3.329 -3.237 1.00 42.22 H new ATOM 0 HG22 VAL A 2 6.886 3.155 -1.475 1.00 42.22 H new ATOM 0 HG23 VAL A 2 6.103 1.992 -2.571 1.00 42.22 H new ATOM 34 N ASN A 3 3.284 5.443 -0.185 1.00 4.34 N ATOM 35 CA ASN A 3 2.350 6.533 0.073 1.00 40.11 C ATOM 36 C ASN A 3 3.071 7.878 0.077 1.00 74.12 C ATOM 37 O ASN A 3 4.275 7.964 0.316 1.00 2.13 O ATOM 38 CB ASN A 3 1.640 6.318 1.411 1.00 51.40 C ATOM 39 CG ASN A 3 0.249 5.739 1.241 1.00 54.42 C ATOM 40 OD1 ASN A 3 -0.532 6.204 0.409 1.00 25.32 O ATOM 41 ND2 ASN A 3 -0.069 4.720 2.031 1.00 45.05 N ATOM 0 H ASN A 3 4.057 5.384 0.478 1.00 4.34 H new ATOM 0 HA ASN A 3 1.609 6.540 -0.727 1.00 40.11 H new ATOM 0 HB2 ASN A 3 2.236 5.649 2.032 1.00 51.40 H new ATOM 0 HB3 ASN A 3 1.573 7.268 1.940 1.00 51.40 H new ATOM 0 HD21 ASN A 3 -0.992 4.290 1.963 1.00 45.05 H new ATOM 0 HD22 ASN A 3 0.609 4.367 2.706 1.00 45.05 H new ATOM 48 N PRO A 4 2.317 8.954 -0.194 1.00 72.21 N ATOM 49 CA PRO A 4 2.862 10.314 -0.227 1.00 12.23 C ATOM 50 C PRO A 4 3.253 10.815 1.159 1.00 12.53 C ATOM 51 O PRO A 4 2.612 10.480 2.156 1.00 3.23 O ATOM 52 CB PRO A 4 1.706 11.146 -0.790 1.00 25.32 C ATOM 53 CG PRO A 4 0.480 10.375 -0.441 1.00 1.43 C ATOM 54 CD PRO A 4 0.874 8.925 -0.489 1.00 3.12 C ATOM 0 HA PRO A 4 3.775 10.373 -0.819 1.00 12.23 H new ATOM 0 HB2 PRO A 4 1.685 12.143 -0.351 1.00 25.32 H new ATOM 0 HB3 PRO A 4 1.799 11.275 -1.868 1.00 25.32 H new ATOM 0 HG2 PRO A 4 0.116 10.648 0.550 1.00 1.43 H new ATOM 0 HG3 PRO A 4 -0.326 10.584 -1.145 1.00 1.43 H new ATOM 0 HD2 PRO A 4 0.325 8.335 0.245 1.00 3.12 H new ATOM 0 HD3 PRO A 4 0.672 8.486 -1.466 1.00 3.12 H new ATOM 62 N THR A 5 4.309 11.621 1.216 1.00 14.42 N ATOM 63 CA THR A 5 4.785 12.168 2.480 1.00 4.41 C ATOM 64 C THR A 5 5.078 13.660 2.358 1.00 30.53 C ATOM 65 O THR A 5 6.092 14.059 1.785 1.00 74.21 O ATOM 66 CB THR A 5 6.057 11.445 2.961 1.00 23.12 C ATOM 67 OG1 THR A 5 5.720 10.153 3.479 1.00 11.44 O ATOM 68 CG2 THR A 5 6.769 12.257 4.033 1.00 61.22 C ATOM 0 H THR A 5 4.851 11.909 0.401 1.00 14.42 H new ATOM 0 HA THR A 5 3.990 12.015 3.210 1.00 4.41 H new ATOM 0 HB THR A 5 6.727 11.331 2.109 1.00 23.12 H new ATOM 0 HG1 THR A 5 6.534 9.699 3.781 1.00 11.44 H new ATOM 0 HG21 THR A 5 7.664 11.726 4.357 1.00 61.22 H new ATOM 0 HG22 THR A 5 7.050 13.229 3.627 1.00 61.22 H new ATOM 0 HG23 THR A 5 6.103 12.399 4.884 1.00 61.22 H new ATOM 76 N VAL A 6 4.184 14.480 2.902 1.00 22.41 N ATOM 77 CA VAL A 6 4.348 15.928 2.856 1.00 72.31 C ATOM 78 C VAL A 6 4.889 16.462 4.177 1.00 12.12 C ATOM 79 O VAL A 6 4.997 15.727 5.159 1.00 72.01 O ATOM 80 CB VAL A 6 3.016 16.633 2.536 1.00 23.01 C ATOM 81 CG1 VAL A 6 2.256 15.876 1.458 1.00 21.41 C ATOM 82 CG2 VAL A 6 2.174 16.775 3.795 1.00 54.15 C ATOM 0 H VAL A 6 3.339 14.166 3.379 1.00 22.41 H new ATOM 0 HA VAL A 6 5.063 16.141 2.062 1.00 72.31 H new ATOM 0 HB VAL A 6 3.235 17.632 2.158 1.00 23.01 H new ATOM 0 HG11 VAL A 6 1.318 16.389 1.246 1.00 21.41 H new ATOM 0 HG12 VAL A 6 2.859 15.832 0.551 1.00 21.41 H new ATOM 0 HG13 VAL A 6 2.046 14.864 1.804 1.00 21.41 H new ATOM 0 HG21 VAL A 6 1.237 17.275 3.551 1.00 54.15 H new ATOM 0 HG22 VAL A 6 1.963 15.787 4.205 1.00 54.15 H new ATOM 0 HG23 VAL A 6 2.719 17.365 4.532 1.00 54.15 H new ATOM 92 N PHE A 7 5.227 17.747 4.195 1.00 24.02 N ATOM 93 CA PHE A 7 5.758 18.381 5.396 1.00 22.14 C ATOM 94 C PHE A 7 5.607 19.898 5.323 1.00 62.40 C ATOM 95 O PHE A 7 5.212 20.444 4.293 1.00 41.20 O ATOM 96 CB PHE A 7 7.231 18.012 5.585 1.00 42.31 C ATOM 97 CG PHE A 7 8.181 19.037 5.033 1.00 31.23 C ATOM 98 CD1 PHE A 7 8.226 19.298 3.673 1.00 31.14 C ATOM 99 CD2 PHE A 7 9.029 19.739 5.875 1.00 61.52 C ATOM 100 CE1 PHE A 7 9.098 20.240 3.162 1.00 4.45 C ATOM 101 CE2 PHE A 7 9.903 20.682 5.370 1.00 43.42 C ATOM 102 CZ PHE A 7 9.939 20.933 4.012 1.00 71.21 C ATOM 0 H PHE A 7 5.143 18.370 3.392 1.00 24.02 H new ATOM 0 HA PHE A 7 5.187 18.018 6.251 1.00 22.14 H new ATOM 0 HB2 PHE A 7 7.430 17.879 6.648 1.00 42.31 H new ATOM 0 HB3 PHE A 7 7.422 17.054 5.102 1.00 42.31 H new ATOM 0 HD1 PHE A 7 7.572 18.759 3.004 1.00 31.14 H new ATOM 0 HD2 PHE A 7 9.006 19.547 6.937 1.00 61.52 H new ATOM 0 HE1 PHE A 7 9.122 20.435 2.100 1.00 4.45 H new ATOM 0 HE2 PHE A 7 10.558 21.223 6.037 1.00 43.42 H new ATOM 0 HZ PHE A 7 10.623 21.669 3.616 1.00 71.21 H new ATOM 112 N PHE A 8 5.924 20.572 6.423 1.00 22.45 N ATOM 113 CA PHE A 8 5.823 22.025 6.486 1.00 53.04 C ATOM 114 C PHE A 8 6.799 22.595 7.510 1.00 0.14 C ATOM 115 O PHE A 8 6.498 22.657 8.703 1.00 63.03 O ATOM 116 CB PHE A 8 4.394 22.443 6.838 1.00 13.14 C ATOM 117 CG PHE A 8 3.348 21.774 5.994 1.00 75.33 C ATOM 118 CD1 PHE A 8 2.805 20.557 6.375 1.00 53.22 C ATOM 119 CD2 PHE A 8 2.907 22.361 4.819 1.00 55.30 C ATOM 120 CE1 PHE A 8 1.843 19.939 5.599 1.00 74.11 C ATOM 121 CE2 PHE A 8 1.944 21.748 4.039 1.00 22.21 C ATOM 122 CZ PHE A 8 1.411 20.535 4.430 1.00 12.43 C ATOM 0 H PHE A 8 6.253 20.135 7.284 1.00 22.45 H new ATOM 0 HA PHE A 8 6.080 22.425 5.505 1.00 53.04 H new ATOM 0 HB2 PHE A 8 4.205 22.213 7.887 1.00 13.14 H new ATOM 0 HB3 PHE A 8 4.302 23.523 6.727 1.00 13.14 H new ATOM 0 HD1 PHE A 8 3.137 20.086 7.289 1.00 53.22 H new ATOM 0 HD2 PHE A 8 3.321 23.309 4.509 1.00 55.30 H new ATOM 0 HE1 PHE A 8 1.429 18.990 5.906 1.00 74.11 H new ATOM 0 HE2 PHE A 8 1.609 22.217 3.126 1.00 22.21 H new ATOM 0 HZ PHE A 8 0.658 20.054 3.823 1.00 12.43 H new ATOM 132 N ASP A 9 7.969 23.010 7.037 1.00 31.40 N ATOM 133 CA ASP A 9 8.990 23.575 7.911 1.00 43.22 C ATOM 134 C ASP A 9 8.379 24.580 8.882 1.00 32.02 C ATOM 135 O ASP A 9 8.047 25.703 8.501 1.00 33.14 O ATOM 136 CB ASP A 9 10.085 24.249 7.082 1.00 54.41 C ATOM 137 CG ASP A 9 11.449 24.150 7.735 1.00 44.24 C ATOM 138 OD1 ASP A 9 12.141 23.134 7.512 1.00 2.35 O ATOM 139 OD2 ASP A 9 11.826 25.089 8.467 1.00 70.22 O ATOM 0 H ASP A 9 8.234 22.966 6.053 1.00 31.40 H new ATOM 0 HA ASP A 9 9.430 22.761 8.488 1.00 43.22 H new ATOM 0 HB2 ASP A 9 10.124 23.789 6.095 1.00 54.41 H new ATOM 0 HB3 ASP A 9 9.831 25.299 6.935 1.00 54.41 H new ATOM 144 N ILE A 10 8.232 24.168 10.137 1.00 42.21 N ATOM 145 CA ILE A 10 7.661 25.032 11.162 1.00 14.42 C ATOM 146 C ILE A 10 8.668 26.080 11.623 1.00 65.14 C ATOM 147 O ILE A 10 9.847 25.781 11.811 1.00 44.23 O ATOM 148 CB ILE A 10 7.187 24.221 12.382 1.00 33.14 C ATOM 149 CG1 ILE A 10 6.159 23.171 11.956 1.00 62.51 C ATOM 150 CG2 ILE A 10 6.600 25.146 13.438 1.00 32.11 C ATOM 151 CD1 ILE A 10 4.842 23.762 11.504 1.00 44.02 C ATOM 0 H ILE A 10 8.501 23.241 10.468 1.00 42.21 H new ATOM 0 HA ILE A 10 6.803 25.530 10.711 1.00 14.42 H new ATOM 0 HB ILE A 10 8.046 23.707 12.814 1.00 33.14 H new ATOM 0 HG12 ILE A 10 6.577 22.573 11.146 1.00 62.51 H new ATOM 0 HG13 ILE A 10 5.977 22.494 12.790 1.00 62.51 H new ATOM 0 HG21 ILE A 10 6.270 24.558 14.294 1.00 32.11 H new ATOM 0 HG22 ILE A 10 7.359 25.859 13.759 1.00 32.11 H new ATOM 0 HG23 ILE A 10 5.750 25.685 13.018 1.00 32.11 H new ATOM 0 HD11 ILE A 10 4.162 22.959 11.217 1.00 44.02 H new ATOM 0 HD12 ILE A 10 4.402 24.336 12.319 1.00 44.02 H new ATOM 0 HD13 ILE A 10 5.011 24.417 10.649 1.00 44.02 H new ATOM 163 N ALA A 11 8.196 27.309 11.804 1.00 35.42 N ATOM 164 CA ALA A 11 9.054 28.400 12.247 1.00 43.13 C ATOM 165 C ALA A 11 8.434 29.144 13.425 1.00 61.42 C ATOM 166 O ALA A 11 7.265 28.941 13.754 1.00 23.31 O ATOM 167 CB ALA A 11 9.323 29.360 11.097 1.00 71.31 C ATOM 0 H ALA A 11 7.223 27.574 11.650 1.00 35.42 H new ATOM 0 HA ALA A 11 10.000 27.973 12.579 1.00 43.13 H new ATOM 0 HB1 ALA A 11 9.965 30.170 11.442 1.00 71.31 H new ATOM 0 HB2 ALA A 11 9.817 28.826 10.285 1.00 71.31 H new ATOM 0 HB3 ALA A 11 8.380 29.772 10.739 1.00 71.31 H new ATOM 173 N VAL A 12 9.224 30.005 14.057 1.00 4.13 N ATOM 174 CA VAL A 12 8.753 30.779 15.199 1.00 15.40 C ATOM 175 C VAL A 12 9.373 32.172 15.213 1.00 53.03 C ATOM 176 O VAL A 12 10.510 32.352 15.649 1.00 52.12 O ATOM 177 CB VAL A 12 9.076 30.072 16.529 1.00 54.43 C ATOM 178 CG1 VAL A 12 8.621 30.919 17.708 1.00 63.01 C ATOM 179 CG2 VAL A 12 8.430 28.696 16.570 1.00 21.42 C ATOM 0 H VAL A 12 10.194 30.184 13.797 1.00 4.13 H new ATOM 0 HA VAL A 12 7.671 30.867 15.096 1.00 15.40 H new ATOM 0 HB VAL A 12 10.156 29.944 16.600 1.00 54.43 H new ATOM 0 HG11 VAL A 12 8.857 30.404 18.639 1.00 63.01 H new ATOM 0 HG12 VAL A 12 9.134 31.880 17.685 1.00 63.01 H new ATOM 0 HG13 VAL A 12 7.545 31.081 17.646 1.00 63.01 H new ATOM 0 HG21 VAL A 12 8.668 28.210 17.516 1.00 21.42 H new ATOM 0 HG22 VAL A 12 7.349 28.799 16.477 1.00 21.42 H new ATOM 0 HG23 VAL A 12 8.809 28.091 15.746 1.00 21.42 H new ATOM 189 N ASP A 13 8.618 33.154 14.733 1.00 11.31 N ATOM 190 CA ASP A 13 9.092 34.533 14.691 1.00 25.43 C ATOM 191 C ASP A 13 10.222 34.688 13.678 1.00 53.05 C ATOM 192 O ASP A 13 11.050 35.590 13.789 1.00 3.54 O ATOM 193 CB ASP A 13 9.570 34.972 16.076 1.00 13.33 C ATOM 194 CG ASP A 13 8.817 36.184 16.590 1.00 3.02 C ATOM 195 OD1 ASP A 13 8.395 37.016 15.760 1.00 32.51 O ATOM 196 OD2 ASP A 13 8.652 36.301 17.823 1.00 54.23 O ATOM 0 H ASP A 13 7.675 33.021 14.367 1.00 11.31 H new ATOM 0 HA ASP A 13 8.261 35.168 14.383 1.00 25.43 H new ATOM 0 HB2 ASP A 13 9.448 34.147 16.778 1.00 13.33 H new ATOM 0 HB3 ASP A 13 10.635 35.200 16.034 1.00 13.33 H new ATOM 201 N GLY A 14 10.248 33.800 12.688 1.00 44.21 N ATOM 202 CA GLY A 14 11.281 33.855 11.669 1.00 13.54 C ATOM 203 C GLY A 14 12.284 32.726 11.799 1.00 51.51 C ATOM 204 O GLY A 14 12.880 32.302 10.810 1.00 60.32 O ATOM 0 H GLY A 14 9.573 33.044 12.573 1.00 44.21 H new ATOM 0 HA2 GLY A 14 10.817 33.813 10.683 1.00 13.54 H new ATOM 0 HA3 GLY A 14 11.803 34.810 11.736 1.00 13.54 H new ATOM 208 N GLU A 15 12.472 32.241 13.022 1.00 34.11 N ATOM 209 CA GLU A 15 13.412 31.156 13.277 1.00 61.05 C ATOM 210 C GLU A 15 12.759 29.800 13.026 1.00 33.24 C ATOM 211 O GLU A 15 11.706 29.478 13.578 1.00 2.23 O ATOM 212 CB GLU A 15 13.930 31.227 14.714 1.00 3.24 C ATOM 213 CG GLU A 15 13.039 30.517 15.719 1.00 75.33 C ATOM 214 CD GLU A 15 13.231 31.028 17.133 1.00 32.45 C ATOM 215 OE1 GLU A 15 13.678 32.183 17.291 1.00 63.04 O ATOM 216 OE2 GLU A 15 12.934 30.273 18.083 1.00 63.21 O ATOM 0 H GLU A 15 11.986 32.582 13.851 1.00 34.11 H new ATOM 0 HA GLU A 15 14.251 31.268 12.591 1.00 61.05 H new ATOM 0 HB2 GLU A 15 14.928 30.790 14.753 1.00 3.24 H new ATOM 0 HB3 GLU A 15 14.029 32.273 15.004 1.00 3.24 H new ATOM 0 HG2 GLU A 15 11.996 30.646 15.429 1.00 75.33 H new ATOM 0 HG3 GLU A 15 13.248 29.448 15.692 1.00 75.33 H new ATOM 223 N PRO A 16 13.397 28.985 12.173 1.00 34.43 N ATOM 224 CA PRO A 16 12.896 27.650 11.830 1.00 45.12 C ATOM 225 C PRO A 16 13.003 26.673 12.996 1.00 55.40 C ATOM 226 O PRO A 16 14.094 26.413 13.504 1.00 61.23 O ATOM 227 CB PRO A 16 13.810 27.214 10.682 1.00 61.51 C ATOM 228 CG PRO A 16 15.069 27.984 10.885 1.00 13.23 C ATOM 229 CD PRO A 16 14.656 29.303 11.479 1.00 74.41 C ATOM 0 HA PRO A 16 11.838 27.666 11.569 1.00 45.12 H new ATOM 0 HB2 PRO A 16 13.994 26.140 10.709 1.00 61.51 H new ATOM 0 HB3 PRO A 16 13.362 27.436 9.713 1.00 61.51 H new ATOM 0 HG2 PRO A 16 15.749 27.452 11.550 1.00 13.23 H new ATOM 0 HG3 PRO A 16 15.595 28.128 9.941 1.00 13.23 H new ATOM 0 HD2 PRO A 16 15.409 29.687 12.168 1.00 74.41 H new ATOM 0 HD3 PRO A 16 14.511 30.062 10.710 1.00 74.41 H new ATOM 237 N LEU A 17 11.863 26.135 13.416 1.00 0.33 N ATOM 238 CA LEU A 17 11.828 25.186 14.523 1.00 32.13 C ATOM 239 C LEU A 17 12.541 23.890 14.152 1.00 24.11 C ATOM 240 O LEU A 17 13.286 23.328 14.954 1.00 61.31 O ATOM 241 CB LEU A 17 10.381 24.889 14.920 1.00 33.15 C ATOM 242 CG LEU A 17 9.824 25.704 16.088 1.00 2.41 C ATOM 243 CD1 LEU A 17 8.311 25.570 16.160 1.00 21.31 C ATOM 244 CD2 LEU A 17 10.463 25.266 17.398 1.00 65.25 C ATOM 0 H LEU A 17 10.951 26.340 13.007 1.00 0.33 H new ATOM 0 HA LEU A 17 12.346 25.635 15.370 1.00 32.13 H new ATOM 0 HB2 LEU A 17 9.745 25.056 14.051 1.00 33.15 H new ATOM 0 HB3 LEU A 17 10.304 23.831 15.172 1.00 33.15 H new ATOM 0 HG LEU A 17 10.067 26.753 15.921 1.00 2.41 H new ATOM 0 HD11 LEU A 17 7.933 26.157 16.997 1.00 21.31 H new ATOM 0 HD12 LEU A 17 7.869 25.934 15.233 1.00 21.31 H new ATOM 0 HD13 LEU A 17 8.045 24.523 16.302 1.00 21.31 H new ATOM 0 HD21 LEU A 17 10.054 25.857 18.218 1.00 65.25 H new ATOM 0 HD22 LEU A 17 10.252 24.211 17.571 1.00 65.25 H new ATOM 0 HD23 LEU A 17 11.541 25.416 17.345 1.00 65.25 H new ATOM 256 N GLY A 18 12.310 23.422 12.929 1.00 31.12 N ATOM 257 CA GLY A 18 12.940 22.197 12.472 1.00 35.12 C ATOM 258 C GLY A 18 12.227 21.588 11.281 1.00 51.21 C ATOM 259 O GLY A 18 11.936 22.279 10.304 1.00 61.41 O ATOM 0 H GLY A 18 11.698 23.869 12.247 1.00 31.12 H new ATOM 0 HA2 GLY A 18 13.976 22.403 12.205 1.00 35.12 H new ATOM 0 HA3 GLY A 18 12.959 21.475 13.288 1.00 35.12 H new ATOM 263 N ARG A 19 11.946 20.292 11.360 1.00 22.43 N ATOM 264 CA ARG A 19 11.266 19.590 10.279 1.00 71.53 C ATOM 265 C ARG A 19 10.043 18.841 10.801 1.00 52.41 C ATOM 266 O ARG A 19 10.096 18.198 11.849 1.00 22.10 O ATOM 267 CB ARG A 19 12.223 18.610 9.596 1.00 10.53 C ATOM 268 CG ARG A 19 12.198 18.693 8.079 1.00 63.52 C ATOM 269 CD ARG A 19 11.907 17.338 7.452 1.00 31.13 C ATOM 270 NE ARG A 19 12.586 17.170 6.170 1.00 4.15 N ATOM 271 CZ ARG A 19 13.865 16.831 6.056 1.00 65.44 C ATOM 272 NH1 ARG A 19 14.600 16.623 7.140 1.00 53.41 N ATOM 273 NH2 ARG A 19 14.412 16.697 4.854 1.00 44.20 N ATOM 0 H ARG A 19 12.179 19.706 12.162 1.00 22.43 H new ATOM 0 HA ARG A 19 10.935 20.331 9.551 1.00 71.53 H new ATOM 0 HB2 ARG A 19 13.237 18.803 9.945 1.00 10.53 H new ATOM 0 HB3 ARG A 19 11.968 17.595 9.900 1.00 10.53 H new ATOM 0 HG2 ARG A 19 11.440 19.411 7.765 1.00 63.52 H new ATOM 0 HG3 ARG A 19 13.157 19.064 7.718 1.00 63.52 H new ATOM 0 HD2 ARG A 19 12.221 16.548 8.134 1.00 31.13 H new ATOM 0 HD3 ARG A 19 10.832 17.228 7.310 1.00 31.13 H new ATOM 0 HE ARG A 19 12.049 17.321 5.316 1.00 4.15 H new ATOM 0 HH11 ARG A 19 14.183 16.723 8.066 1.00 53.41 H new ATOM 0 HH12 ARG A 19 15.582 16.363 7.048 1.00 53.41 H new ATOM 0 HH21 ARG A 19 13.850 16.854 4.017 1.00 44.20 H new ATOM 0 HH22 ARG A 19 15.394 16.437 4.767 1.00 44.20 H new ATOM 287 N VAL A 20 8.941 18.931 10.063 1.00 51.13 N ATOM 288 CA VAL A 20 7.705 18.263 10.450 1.00 35.44 C ATOM 289 C VAL A 20 6.963 17.727 9.230 1.00 4.25 C ATOM 290 O VAL A 20 6.283 18.474 8.527 1.00 3.32 O ATOM 291 CB VAL A 20 6.773 19.212 11.227 1.00 21.15 C ATOM 292 CG1 VAL A 20 5.974 18.443 12.268 1.00 22.44 C ATOM 293 CG2 VAL A 20 7.574 20.330 11.878 1.00 64.34 C ATOM 0 H VAL A 20 8.880 19.460 9.193 1.00 51.13 H new ATOM 0 HA VAL A 20 7.985 17.431 11.096 1.00 35.44 H new ATOM 0 HB VAL A 20 6.071 19.660 10.523 1.00 21.15 H new ATOM 0 HG11 VAL A 20 5.322 19.130 12.807 1.00 22.44 H new ATOM 0 HG12 VAL A 20 5.370 17.682 11.774 1.00 22.44 H new ATOM 0 HG13 VAL A 20 6.657 17.965 12.971 1.00 22.44 H new ATOM 0 HG21 VAL A 20 6.900 20.991 12.423 1.00 64.34 H new ATOM 0 HG22 VAL A 20 8.300 19.902 12.569 1.00 64.34 H new ATOM 0 HG23 VAL A 20 8.097 20.899 11.109 1.00 64.34 H new ATOM 303 N SER A 21 7.099 16.428 8.985 1.00 24.14 N ATOM 304 CA SER A 21 6.445 15.792 7.848 1.00 42.01 C ATOM 305 C SER A 21 5.314 14.880 8.312 1.00 33.11 C ATOM 306 O SER A 21 5.136 14.652 9.509 1.00 60.21 O ATOM 307 CB SER A 21 7.460 14.989 7.032 1.00 43.31 C ATOM 308 OG SER A 21 6.861 13.839 6.462 1.00 71.23 O ATOM 0 H SER A 21 7.656 15.795 9.559 1.00 24.14 H new ATOM 0 HA SER A 21 6.022 16.576 7.219 1.00 42.01 H new ATOM 0 HB2 SER A 21 7.874 15.616 6.243 1.00 43.31 H new ATOM 0 HB3 SER A 21 8.291 14.691 7.671 1.00 43.31 H new ATOM 0 HG SER A 21 7.536 13.136 6.358 1.00 71.23 H new ATOM 314 N PHE A 22 4.551 14.361 7.356 1.00 74.20 N ATOM 315 CA PHE A 22 3.435 13.474 7.665 1.00 11.13 C ATOM 316 C PHE A 22 3.271 12.409 6.585 1.00 41.00 C ATOM 317 O PHE A 22 3.495 12.670 5.403 1.00 35.14 O ATOM 318 CB PHE A 22 2.141 14.278 7.805 1.00 14.02 C ATOM 319 CG PHE A 22 2.264 15.456 8.729 1.00 55.34 C ATOM 320 CD1 PHE A 22 2.084 15.305 10.094 1.00 23.21 C ATOM 321 CD2 PHE A 22 2.558 16.715 8.231 1.00 51.41 C ATOM 322 CE1 PHE A 22 2.197 16.387 10.947 1.00 61.13 C ATOM 323 CE2 PHE A 22 2.672 17.801 9.079 1.00 44.05 C ATOM 324 CZ PHE A 22 2.491 17.637 10.438 1.00 75.11 C ATOM 0 H PHE A 22 4.685 14.539 6.361 1.00 74.20 H new ATOM 0 HA PHE A 22 3.650 12.977 8.611 1.00 11.13 H new ATOM 0 HB2 PHE A 22 1.833 14.629 6.820 1.00 14.02 H new ATOM 0 HB3 PHE A 22 1.352 13.621 8.170 1.00 14.02 H new ATOM 0 HD1 PHE A 22 1.853 14.330 10.497 1.00 23.21 H new ATOM 0 HD2 PHE A 22 2.700 16.850 7.169 1.00 51.41 H new ATOM 0 HE1 PHE A 22 2.056 16.255 12.010 1.00 61.13 H new ATOM 0 HE2 PHE A 22 2.903 18.777 8.679 1.00 44.05 H new ATOM 0 HZ PHE A 22 2.579 18.484 11.102 1.00 75.11 H new ATOM 334 N GLU A 23 2.880 11.208 7.001 1.00 40.35 N ATOM 335 CA GLU A 23 2.688 10.103 6.069 1.00 52.43 C ATOM 336 C GLU A 23 1.209 9.917 5.744 1.00 75.32 C ATOM 337 O GLU A 23 0.469 9.288 6.502 1.00 21.31 O ATOM 338 CB GLU A 23 3.260 8.810 6.652 1.00 64.23 C ATOM 339 CG GLU A 23 2.814 7.559 5.913 1.00 42.32 C ATOM 340 CD GLU A 23 3.479 6.302 6.439 1.00 10.22 C ATOM 341 OE1 GLU A 23 4.647 6.052 6.077 1.00 5.10 O ATOM 342 OE2 GLU A 23 2.830 5.569 7.214 1.00 31.40 O ATOM 0 H GLU A 23 2.690 10.976 7.976 1.00 40.35 H new ATOM 0 HA GLU A 23 3.218 10.342 5.147 1.00 52.43 H new ATOM 0 HB2 GLU A 23 4.349 8.864 6.634 1.00 64.23 H new ATOM 0 HB3 GLU A 23 2.962 8.730 7.697 1.00 64.23 H new ATOM 0 HG2 GLU A 23 1.732 7.457 6.000 1.00 42.32 H new ATOM 0 HG3 GLU A 23 3.040 7.668 4.852 1.00 42.32 H new ATOM 349 N LEU A 24 0.783 10.468 4.612 1.00 24.14 N ATOM 350 CA LEU A 24 -0.608 10.363 4.186 1.00 42.41 C ATOM 351 C LEU A 24 -0.865 9.031 3.488 1.00 0.54 C ATOM 352 O LEU A 24 -0.144 8.653 2.564 1.00 15.34 O ATOM 353 CB LEU A 24 -0.963 11.520 3.249 1.00 21.53 C ATOM 354 CG LEU A 24 -0.596 12.920 3.742 1.00 23.41 C ATOM 355 CD1 LEU A 24 -0.144 13.793 2.582 1.00 70.43 C ATOM 356 CD2 LEU A 24 -1.774 13.557 4.464 1.00 22.13 C ATOM 0 H LEU A 24 1.381 10.992 3.973 1.00 24.14 H new ATOM 0 HA LEU A 24 -1.239 10.415 5.073 1.00 42.41 H new ATOM 0 HB2 LEU A 24 -0.467 11.352 2.293 1.00 21.53 H new ATOM 0 HB3 LEU A 24 -2.036 11.493 3.061 1.00 21.53 H new ATOM 0 HG LEU A 24 0.231 12.831 4.446 1.00 23.41 H new ATOM 0 HD11 LEU A 24 0.113 14.785 2.952 1.00 70.43 H new ATOM 0 HD12 LEU A 24 0.729 13.345 2.108 1.00 70.43 H new ATOM 0 HD13 LEU A 24 -0.950 13.875 1.853 1.00 70.43 H new ATOM 0 HD21 LEU A 24 -1.495 14.553 4.808 1.00 22.13 H new ATOM 0 HD22 LEU A 24 -2.621 13.633 3.782 1.00 22.13 H new ATOM 0 HD23 LEU A 24 -2.052 12.942 5.320 1.00 22.13 H new ATOM 368 N PHE A 25 -1.898 8.325 3.936 1.00 40.15 N ATOM 369 CA PHE A 25 -2.252 7.036 3.354 1.00 65.44 C ATOM 370 C PHE A 25 -3.183 7.215 2.158 1.00 4.31 C ATOM 371 O PHE A 25 -4.351 6.831 2.204 1.00 24.32 O ATOM 372 CB PHE A 25 -2.918 6.144 4.403 1.00 25.25 C ATOM 373 CG PHE A 25 -2.115 6.001 5.665 1.00 12.42 C ATOM 374 CD1 PHE A 25 -2.153 6.985 6.641 1.00 75.42 C ATOM 375 CD2 PHE A 25 -1.323 4.884 5.876 1.00 51.31 C ATOM 376 CE1 PHE A 25 -1.415 6.856 7.802 1.00 15.33 C ATOM 377 CE2 PHE A 25 -0.583 4.750 7.036 1.00 51.33 C ATOM 378 CZ PHE A 25 -0.630 5.737 8.001 1.00 53.35 C ATOM 0 H PHE A 25 -2.504 8.624 4.700 1.00 40.15 H new ATOM 0 HA PHE A 25 -1.335 6.558 3.010 1.00 65.44 H new ATOM 0 HB2 PHE A 25 -3.897 6.555 4.649 1.00 25.25 H new ATOM 0 HB3 PHE A 25 -3.086 5.156 3.975 1.00 25.25 H new ATOM 0 HD1 PHE A 25 -2.766 7.862 6.492 1.00 75.42 H new ATOM 0 HD2 PHE A 25 -1.283 4.109 5.125 1.00 51.31 H new ATOM 0 HE1 PHE A 25 -1.452 7.630 8.554 1.00 15.33 H new ATOM 0 HE2 PHE A 25 0.031 3.875 7.187 1.00 51.33 H new ATOM 0 HZ PHE A 25 -0.054 5.634 8.909 1.00 53.35 H new ATOM 388 N ALA A 26 -2.656 7.803 1.089 1.00 50.32 N ATOM 389 CA ALA A 26 -3.438 8.033 -0.119 1.00 53.24 C ATOM 390 C ALA A 26 -4.022 6.729 -0.652 1.00 14.03 C ATOM 391 O ALA A 26 -5.013 6.734 -1.383 1.00 0.22 O ATOM 392 CB ALA A 26 -2.581 8.703 -1.183 1.00 74.04 C ATOM 0 H ALA A 26 -1.691 8.129 1.035 1.00 50.32 H new ATOM 0 HA ALA A 26 -4.266 8.695 0.135 1.00 53.24 H new ATOM 0 HB1 ALA A 26 -3.178 8.869 -2.080 1.00 74.04 H new ATOM 0 HB2 ALA A 26 -2.217 9.659 -0.808 1.00 74.04 H new ATOM 0 HB3 ALA A 26 -1.734 8.062 -1.425 1.00 74.04 H new ATOM 398 N ASP A 27 -3.403 5.614 -0.281 1.00 43.01 N ATOM 399 CA ASP A 27 -3.862 4.302 -0.721 1.00 63.32 C ATOM 400 C ASP A 27 -5.244 3.992 -0.156 1.00 31.45 C ATOM 401 O ASP A 27 -6.059 3.335 -0.804 1.00 15.41 O ATOM 402 CB ASP A 27 -2.868 3.220 -0.294 1.00 1.40 C ATOM 403 CG ASP A 27 -2.887 2.975 1.202 1.00 74.31 C ATOM 404 OD1 ASP A 27 -2.834 3.961 1.966 1.00 15.13 O ATOM 405 OD2 ASP A 27 -2.956 1.796 1.608 1.00 14.12 O ATOM 0 H ASP A 27 -2.582 5.592 0.324 1.00 43.01 H new ATOM 0 HA ASP A 27 -3.929 4.314 -1.809 1.00 63.32 H new ATOM 0 HB2 ASP A 27 -3.101 2.291 -0.814 1.00 1.40 H new ATOM 0 HB3 ASP A 27 -1.863 3.513 -0.599 1.00 1.40 H new ATOM 410 N LYS A 28 -5.501 4.467 1.058 1.00 32.03 N ATOM 411 CA LYS A 28 -6.784 4.242 1.713 1.00 75.42 C ATOM 412 C LYS A 28 -7.669 5.481 1.618 1.00 24.13 C ATOM 413 O LYS A 28 -8.894 5.379 1.562 1.00 32.32 O ATOM 414 CB LYS A 28 -6.572 3.864 3.181 1.00 53.23 C ATOM 415 CG LYS A 28 -5.668 2.660 3.374 1.00 24.34 C ATOM 416 CD LYS A 28 -6.463 1.366 3.418 1.00 32.15 C ATOM 417 CE LYS A 28 -5.789 0.327 4.301 1.00 32.14 C ATOM 418 NZ LYS A 28 -5.846 0.702 5.741 1.00 31.25 N ATOM 0 H LYS A 28 -4.837 5.011 1.609 1.00 32.03 H new ATOM 0 HA LYS A 28 -7.285 3.420 1.202 1.00 75.42 H new ATOM 0 HB2 LYS A 28 -6.145 4.717 3.709 1.00 53.23 H new ATOM 0 HB3 LYS A 28 -7.540 3.658 3.638 1.00 53.23 H new ATOM 0 HG2 LYS A 28 -4.943 2.615 2.562 1.00 24.34 H new ATOM 0 HG3 LYS A 28 -5.103 2.773 4.300 1.00 24.34 H new ATOM 0 HD2 LYS A 28 -7.467 1.567 3.792 1.00 32.15 H new ATOM 0 HD3 LYS A 28 -6.573 0.971 2.408 1.00 32.15 H new ATOM 0 HE2 LYS A 28 -6.272 -0.640 4.158 1.00 32.14 H new ATOM 0 HE3 LYS A 28 -4.749 0.212 3.997 1.00 32.14 H new ATOM 0 HZ1 LYS A 28 -4.896 0.627 6.157 1.00 31.25 H new ATOM 0 HZ2 LYS A 28 -6.187 1.680 5.832 1.00 31.25 H new ATOM 0 HZ3 LYS A 28 -6.495 0.061 6.241 1.00 31.25 H new ATOM 432 N VAL A 29 -7.039 6.652 1.600 1.00 60.54 N ATOM 433 CA VAL A 29 -7.769 7.911 1.509 1.00 65.40 C ATOM 434 C VAL A 29 -7.156 8.826 0.455 1.00 4.34 C ATOM 435 O VAL A 29 -6.623 9.894 0.759 1.00 10.00 O ATOM 436 CB VAL A 29 -7.790 8.646 2.862 1.00 22.44 C ATOM 437 CG1 VAL A 29 -9.148 8.495 3.531 1.00 62.22 C ATOM 438 CG2 VAL A 29 -6.681 8.129 3.766 1.00 30.44 C ATOM 0 H VAL A 29 -6.025 6.755 1.647 1.00 60.54 H new ATOM 0 HA VAL A 29 -8.791 7.665 1.222 1.00 65.40 H new ATOM 0 HB VAL A 29 -7.616 9.707 2.682 1.00 22.44 H new ATOM 0 HG11 VAL A 29 -9.144 9.021 4.486 1.00 62.22 H new ATOM 0 HG12 VAL A 29 -9.920 8.917 2.887 1.00 62.22 H new ATOM 0 HG13 VAL A 29 -9.355 7.438 3.700 1.00 62.22 H new ATOM 0 HG21 VAL A 29 -6.711 8.659 4.718 1.00 30.44 H new ATOM 0 HG22 VAL A 29 -6.821 7.062 3.940 1.00 30.44 H new ATOM 0 HG23 VAL A 29 -5.715 8.294 3.288 1.00 30.44 H new ATOM 448 N PRO A 30 -7.232 8.401 -0.814 1.00 43.15 N ATOM 449 CA PRO A 30 -6.690 9.169 -1.940 1.00 74.30 C ATOM 450 C PRO A 30 -7.490 10.438 -2.214 1.00 20.10 C ATOM 451 O PRO A 30 -6.926 11.478 -2.556 1.00 33.30 O ATOM 452 CB PRO A 30 -6.806 8.199 -3.119 1.00 0.02 C ATOM 453 CG PRO A 30 -7.917 7.279 -2.745 1.00 44.11 C ATOM 454 CD PRO A 30 -7.852 7.139 -1.249 1.00 74.43 C ATOM 0 HA PRO A 30 -5.672 9.510 -1.749 1.00 74.30 H new ATOM 0 HB2 PRO A 30 -7.025 8.728 -4.047 1.00 0.02 H new ATOM 0 HB3 PRO A 30 -5.876 7.653 -3.276 1.00 0.02 H new ATOM 0 HG2 PRO A 30 -8.880 7.683 -3.058 1.00 44.11 H new ATOM 0 HG3 PRO A 30 -7.803 6.311 -3.233 1.00 44.11 H new ATOM 0 HD2 PRO A 30 -8.843 7.008 -0.814 1.00 74.43 H new ATOM 0 HD3 PRO A 30 -7.257 6.276 -0.952 1.00 74.43 H new ATOM 462 N LYS A 31 -8.807 10.347 -2.061 1.00 63.43 N ATOM 463 CA LYS A 31 -9.685 11.488 -2.290 1.00 61.23 C ATOM 464 C LYS A 31 -9.335 12.640 -1.354 1.00 43.35 C ATOM 465 O LYS A 31 -9.407 13.809 -1.737 1.00 33.23 O ATOM 466 CB LYS A 31 -11.147 11.081 -2.091 1.00 24.24 C ATOM 467 CG LYS A 31 -12.002 11.257 -3.333 1.00 72.22 C ATOM 468 CD LYS A 31 -11.573 10.313 -4.444 1.00 33.42 C ATOM 469 CE LYS A 31 -12.402 10.520 -5.702 1.00 44.05 C ATOM 470 NZ LYS A 31 -13.808 10.066 -5.522 1.00 33.02 N ATOM 0 H LYS A 31 -9.290 9.494 -1.779 1.00 63.43 H new ATOM 0 HA LYS A 31 -9.544 11.823 -3.318 1.00 61.23 H new ATOM 0 HB2 LYS A 31 -11.185 10.037 -1.779 1.00 24.24 H new ATOM 0 HB3 LYS A 31 -11.573 11.672 -1.280 1.00 24.24 H new ATOM 0 HG2 LYS A 31 -13.048 11.076 -3.084 1.00 72.22 H new ATOM 0 HG3 LYS A 31 -11.931 12.287 -3.682 1.00 72.22 H new ATOM 0 HD2 LYS A 31 -10.519 10.472 -4.671 1.00 33.42 H new ATOM 0 HD3 LYS A 31 -11.674 9.282 -4.106 1.00 33.42 H new ATOM 0 HE2 LYS A 31 -12.393 11.576 -5.973 1.00 44.05 H new ATOM 0 HE3 LYS A 31 -11.948 9.975 -6.530 1.00 44.05 H new ATOM 0 HZ1 LYS A 31 -14.317 10.145 -6.426 1.00 33.02 H new ATOM 0 HZ2 LYS A 31 -13.815 9.075 -5.206 1.00 33.02 H new ATOM 0 HZ3 LYS A 31 -14.276 10.660 -4.808 1.00 33.02 H new ATOM 484 N THR A 32 -8.953 12.304 -0.126 1.00 42.31 N ATOM 485 CA THR A 32 -8.591 13.311 0.864 1.00 61.31 C ATOM 486 C THR A 32 -7.100 13.623 0.811 1.00 23.52 C ATOM 487 O THR A 32 -6.694 14.780 0.911 1.00 52.15 O ATOM 488 CB THR A 32 -8.959 12.855 2.289 1.00 65.04 C ATOM 489 OG1 THR A 32 -10.339 12.480 2.342 1.00 15.11 O ATOM 490 CG2 THR A 32 -8.689 13.961 3.297 1.00 3.32 C ATOM 0 H THR A 32 -8.886 11.342 0.207 1.00 42.31 H new ATOM 0 HA THR A 32 -9.156 14.211 0.621 1.00 61.31 H new ATOM 0 HB THR A 32 -8.340 11.995 2.543 1.00 65.04 H new ATOM 0 HG1 THR A 32 -10.648 12.499 3.272 1.00 15.11 H new ATOM 0 HG21 THR A 32 -8.956 13.616 4.296 1.00 3.32 H new ATOM 0 HG22 THR A 32 -7.631 14.223 3.275 1.00 3.32 H new ATOM 0 HG23 THR A 32 -9.286 14.837 3.044 1.00 3.32 H new ATOM 498 N ALA A 33 -6.288 12.582 0.654 1.00 44.33 N ATOM 499 CA ALA A 33 -4.841 12.746 0.585 1.00 1.20 C ATOM 500 C ALA A 33 -4.438 13.563 -0.638 1.00 74.12 C ATOM 501 O ALA A 33 -3.658 14.509 -0.534 1.00 73.33 O ATOM 502 CB ALA A 33 -4.156 11.388 0.564 1.00 73.55 C ATOM 0 H ALA A 33 -6.608 11.617 0.572 1.00 44.33 H new ATOM 0 HA ALA A 33 -4.520 13.289 1.474 1.00 1.20 H new ATOM 0 HB1 ALA A 33 -3.076 11.526 0.512 1.00 73.55 H new ATOM 0 HB2 ALA A 33 -4.409 10.839 1.471 1.00 73.55 H new ATOM 0 HB3 ALA A 33 -4.492 10.825 -0.307 1.00 73.55 H new ATOM 508 N GLU A 34 -4.975 13.190 -1.796 1.00 14.32 N ATOM 509 CA GLU A 34 -4.670 13.889 -3.039 1.00 23.41 C ATOM 510 C GLU A 34 -4.842 15.396 -2.873 1.00 20.33 C ATOM 511 O GLU A 34 -4.111 16.184 -3.471 1.00 12.12 O ATOM 512 CB GLU A 34 -5.569 13.383 -4.168 1.00 74.15 C ATOM 513 CG GLU A 34 -5.353 14.104 -5.488 1.00 51.22 C ATOM 514 CD GLU A 34 -5.234 13.151 -6.661 1.00 71.24 C ATOM 515 OE1 GLU A 34 -4.325 12.295 -6.639 1.00 60.34 O ATOM 516 OE2 GLU A 34 -6.049 13.261 -7.601 1.00 30.30 O ATOM 0 H GLU A 34 -5.623 12.409 -1.899 1.00 14.32 H new ATOM 0 HA GLU A 34 -3.630 13.686 -3.294 1.00 23.41 H new ATOM 0 HB2 GLU A 34 -5.391 12.317 -4.313 1.00 74.15 H new ATOM 0 HB3 GLU A 34 -6.611 13.495 -3.869 1.00 74.15 H new ATOM 0 HG2 GLU A 34 -6.183 14.789 -5.664 1.00 51.22 H new ATOM 0 HG3 GLU A 34 -4.449 14.709 -5.423 1.00 51.22 H new ATOM 523 N ASN A 35 -5.815 15.788 -2.056 1.00 64.21 N ATOM 524 CA ASN A 35 -6.084 17.200 -1.812 1.00 35.04 C ATOM 525 C ASN A 35 -4.911 17.862 -1.096 1.00 43.24 C ATOM 526 O ASN A 35 -4.244 18.735 -1.652 1.00 44.13 O ATOM 527 CB ASN A 35 -7.359 17.361 -0.980 1.00 61.43 C ATOM 528 CG ASN A 35 -7.370 18.650 -0.182 1.00 50.13 C ATOM 529 OD1 ASN A 35 -6.974 19.704 -0.680 1.00 10.34 O ATOM 530 ND2 ASN A 35 -7.825 18.571 1.063 1.00 41.22 N ATOM 0 H ASN A 35 -6.429 15.148 -1.553 1.00 64.21 H new ATOM 0 HA ASN A 35 -6.222 17.690 -2.776 1.00 35.04 H new ATOM 0 HB2 ASN A 35 -8.226 17.339 -1.641 1.00 61.43 H new ATOM 0 HB3 ASN A 35 -7.455 16.515 -0.300 1.00 61.43 H new ATOM 0 HD21 ASN A 35 -7.856 19.406 1.648 1.00 41.22 H new ATOM 0 HD22 ASN A 35 -8.143 17.676 1.434 1.00 41.22 H new ATOM 537 N PHE A 36 -4.664 17.441 0.139 1.00 21.34 N ATOM 538 CA PHE A 36 -3.571 17.993 0.931 1.00 21.35 C ATOM 539 C PHE A 36 -2.244 17.868 0.188 1.00 0.34 C ATOM 540 O PHE A 36 -1.389 18.751 0.271 1.00 73.44 O ATOM 541 CB PHE A 36 -3.481 17.279 2.282 1.00 2.41 C ATOM 542 CG PHE A 36 -2.778 18.083 3.339 1.00 62.14 C ATOM 543 CD1 PHE A 36 -3.124 19.405 3.567 1.00 45.01 C ATOM 544 CD2 PHE A 36 -1.771 17.516 4.103 1.00 2.11 C ATOM 545 CE1 PHE A 36 -2.479 20.147 4.539 1.00 41.24 C ATOM 546 CE2 PHE A 36 -1.123 18.253 5.076 1.00 1.14 C ATOM 547 CZ PHE A 36 -1.476 19.571 5.294 1.00 75.54 C ATOM 0 H PHE A 36 -5.206 16.719 0.614 1.00 21.34 H new ATOM 0 HA PHE A 36 -3.775 19.050 1.099 1.00 21.35 H new ATOM 0 HB2 PHE A 36 -4.488 17.042 2.626 1.00 2.41 H new ATOM 0 HB3 PHE A 36 -2.958 16.332 2.149 1.00 2.41 H new ATOM 0 HD1 PHE A 36 -3.906 19.861 2.979 1.00 45.01 H new ATOM 0 HD2 PHE A 36 -1.489 16.487 3.936 1.00 2.11 H new ATOM 0 HE1 PHE A 36 -2.759 21.176 4.708 1.00 41.24 H new ATOM 0 HE2 PHE A 36 -0.341 17.799 5.666 1.00 1.14 H new ATOM 0 HZ PHE A 36 -0.969 20.149 6.052 1.00 75.54 H new ATOM 557 N ARG A 37 -2.079 16.766 -0.536 1.00 55.41 N ATOM 558 CA ARG A 37 -0.857 16.525 -1.292 1.00 63.24 C ATOM 559 C ARG A 37 -0.738 17.500 -2.460 1.00 73.54 C ATOM 560 O ARG A 37 0.300 18.132 -2.651 1.00 61.33 O ATOM 561 CB ARG A 37 -0.828 15.086 -1.810 1.00 70.43 C ATOM 562 CG ARG A 37 0.560 14.467 -1.813 1.00 63.03 C ATOM 563 CD ARG A 37 0.759 13.551 -3.011 1.00 24.24 C ATOM 564 NE ARG A 37 0.561 14.253 -4.276 1.00 24.32 N ATOM 565 CZ ARG A 37 0.798 13.707 -5.464 1.00 12.23 C ATOM 566 NH1 ARG A 37 1.238 12.459 -5.548 1.00 40.41 N ATOM 567 NH2 ARG A 37 0.593 14.410 -6.570 1.00 44.15 N ATOM 0 H ARG A 37 -2.777 16.026 -0.615 1.00 55.41 H new ATOM 0 HA ARG A 37 -0.010 16.681 -0.624 1.00 63.24 H new ATOM 0 HB2 ARG A 37 -1.488 14.474 -1.195 1.00 70.43 H new ATOM 0 HB3 ARG A 37 -1.228 15.066 -2.824 1.00 70.43 H new ATOM 0 HG2 ARG A 37 1.312 15.256 -1.828 1.00 63.03 H new ATOM 0 HG3 ARG A 37 0.710 13.902 -0.893 1.00 63.03 H new ATOM 0 HD2 ARG A 37 1.764 13.131 -2.983 1.00 24.24 H new ATOM 0 HD3 ARG A 37 0.063 12.715 -2.948 1.00 24.24 H new ATOM 0 HE ARG A 37 0.222 15.215 -4.246 1.00 24.32 H new ATOM 0 HH11 ARG A 37 1.395 11.916 -4.699 1.00 40.41 H new ATOM 0 HH12 ARG A 37 1.419 12.042 -6.461 1.00 40.41 H new ATOM 0 HH21 ARG A 37 0.253 15.370 -6.509 1.00 44.15 H new ATOM 0 HH22 ARG A 37 0.775 13.991 -7.482 1.00 44.15 H new ATOM 581 N ALA A 38 -1.809 17.615 -3.239 1.00 32.10 N ATOM 582 CA ALA A 38 -1.826 18.513 -4.387 1.00 1.11 C ATOM 583 C ALA A 38 -1.474 19.938 -3.974 1.00 1.20 C ATOM 584 O ALA A 38 -0.991 20.729 -4.785 1.00 40.33 O ATOM 585 CB ALA A 38 -3.188 18.479 -5.064 1.00 20.20 C ATOM 0 H ALA A 38 -2.676 17.097 -3.096 1.00 32.10 H new ATOM 0 HA ALA A 38 -1.072 18.171 -5.096 1.00 1.11 H new ATOM 0 HB1 ALA A 38 -3.186 19.154 -5.920 1.00 20.20 H new ATOM 0 HB2 ALA A 38 -3.401 17.465 -5.403 1.00 20.20 H new ATOM 0 HB3 ALA A 38 -3.954 18.793 -4.356 1.00 20.20 H new ATOM 591 N LEU A 39 -1.719 20.260 -2.709 1.00 11.13 N ATOM 592 CA LEU A 39 -1.428 21.591 -2.188 1.00 14.51 C ATOM 593 C LEU A 39 0.057 21.742 -1.876 1.00 21.22 C ATOM 594 O LEU A 39 0.729 22.620 -2.416 1.00 2.20 O ATOM 595 CB LEU A 39 -2.255 21.860 -0.929 1.00 73.12 C ATOM 596 CG LEU A 39 -3.771 21.916 -1.121 1.00 52.34 C ATOM 597 CD1 LEU A 39 -4.479 21.958 0.224 1.00 3.01 C ATOM 598 CD2 LEU A 39 -4.157 23.121 -1.967 1.00 12.44 C ATOM 0 H LEU A 39 -2.119 19.618 -2.025 1.00 11.13 H new ATOM 0 HA LEU A 39 -1.695 22.319 -2.954 1.00 14.51 H new ATOM 0 HB2 LEU A 39 -2.030 21.083 -0.198 1.00 73.12 H new ATOM 0 HB3 LEU A 39 -1.928 22.807 -0.499 1.00 73.12 H new ATOM 0 HG LEU A 39 -4.085 21.013 -1.645 1.00 52.34 H new ATOM 0 HD11 LEU A 39 -5.557 21.998 0.067 1.00 3.01 H new ATOM 0 HD12 LEU A 39 -4.228 21.064 0.795 1.00 3.01 H new ATOM 0 HD13 LEU A 39 -4.160 22.842 0.776 1.00 3.01 H new ATOM 0 HD21 LEU A 39 -5.239 23.145 -2.093 1.00 12.44 H new ATOM 0 HD22 LEU A 39 -3.829 24.034 -1.470 1.00 12.44 H new ATOM 0 HD23 LEU A 39 -3.679 23.048 -2.944 1.00 12.44 H new ATOM 610 N SER A 40 0.563 20.877 -1.002 1.00 45.24 N ATOM 611 CA SER A 40 1.969 20.915 -0.617 1.00 64.32 C ATOM 612 C SER A 40 2.871 20.702 -1.830 1.00 13.33 C ATOM 613 O SER A 40 3.924 21.329 -1.954 1.00 14.03 O ATOM 614 CB SER A 40 2.259 19.848 0.441 1.00 72.04 C ATOM 615 OG SER A 40 1.059 19.265 0.919 1.00 51.13 O ATOM 0 H SER A 40 0.021 20.142 -0.548 1.00 45.24 H new ATOM 0 HA SER A 40 2.179 21.899 -0.198 1.00 64.32 H new ATOM 0 HB2 SER A 40 2.899 19.075 0.016 1.00 72.04 H new ATOM 0 HB3 SER A 40 2.806 20.294 1.271 1.00 72.04 H new ATOM 0 HG SER A 40 1.271 18.585 1.592 1.00 51.13 H new ATOM 621 N THR A 41 2.450 19.813 -2.724 1.00 33.02 N ATOM 622 CA THR A 41 3.218 19.516 -3.926 1.00 73.32 C ATOM 623 C THR A 41 3.349 20.748 -4.813 1.00 40.35 C ATOM 624 O THR A 41 4.402 20.994 -5.400 1.00 24.15 O ATOM 625 CB THR A 41 2.571 18.379 -4.739 1.00 74.52 C ATOM 626 OG1 THR A 41 1.205 18.699 -5.029 1.00 24.21 O ATOM 627 CG2 THR A 41 2.638 17.063 -3.978 1.00 53.10 C ATOM 0 H THR A 41 1.581 19.286 -2.638 1.00 33.02 H new ATOM 0 HA THR A 41 4.209 19.201 -3.598 1.00 73.32 H new ATOM 0 HB THR A 41 3.124 18.270 -5.672 1.00 74.52 H new ATOM 0 HG1 THR A 41 0.677 18.657 -4.204 1.00 24.21 H new ATOM 0 HG21 THR A 41 2.175 16.275 -4.572 1.00 53.10 H new ATOM 0 HG22 THR A 41 3.680 16.807 -3.785 1.00 53.10 H new ATOM 0 HG23 THR A 41 2.107 17.163 -3.031 1.00 53.10 H new ATOM 635 N GLY A 42 2.272 21.522 -4.907 1.00 74.15 N ATOM 636 CA GLY A 42 2.288 22.721 -5.725 1.00 62.32 C ATOM 637 C GLY A 42 1.459 22.574 -6.986 1.00 0.24 C ATOM 638 O GLY A 42 1.071 23.568 -7.599 1.00 64.34 O ATOM 0 H GLY A 42 1.388 21.340 -4.431 1.00 74.15 H new ATOM 0 HA2 GLY A 42 1.910 23.560 -5.141 1.00 62.32 H new ATOM 0 HA3 GLY A 42 3.317 22.959 -5.996 1.00 62.32 H new ATOM 642 N GLU A 43 1.188 21.332 -7.373 1.00 30.31 N ATOM 643 CA GLU A 43 0.402 21.060 -8.570 1.00 75.13 C ATOM 644 C GLU A 43 -0.910 21.840 -8.549 1.00 3.32 C ATOM 645 O GLU A 43 -1.440 22.215 -9.595 1.00 2.42 O ATOM 646 CB GLU A 43 0.114 19.562 -8.690 1.00 22.34 C ATOM 647 CG GLU A 43 -0.607 18.982 -7.484 1.00 42.41 C ATOM 648 CD GLU A 43 -1.868 18.231 -7.864 1.00 41.01 C ATOM 649 OE1 GLU A 43 -2.880 18.892 -8.177 1.00 51.32 O ATOM 650 OE2 GLU A 43 -1.843 16.983 -7.848 1.00 70.31 O ATOM 0 H GLU A 43 1.501 20.499 -6.875 1.00 30.31 H new ATOM 0 HA GLU A 43 0.983 21.382 -9.434 1.00 75.13 H new ATOM 0 HB2 GLU A 43 -0.488 19.387 -9.582 1.00 22.34 H new ATOM 0 HB3 GLU A 43 1.055 19.030 -8.831 1.00 22.34 H new ATOM 0 HG2 GLU A 43 0.066 18.309 -6.952 1.00 42.41 H new ATOM 0 HG3 GLU A 43 -0.862 19.788 -6.796 1.00 42.41 H new ATOM 657 N LYS A 44 -1.428 22.081 -7.349 1.00 74.15 N ATOM 658 CA LYS A 44 -2.677 22.817 -7.189 1.00 21.21 C ATOM 659 C LYS A 44 -2.565 24.216 -7.787 1.00 22.51 C ATOM 660 O LYS A 44 -3.546 24.771 -8.279 1.00 0.45 O ATOM 661 CB LYS A 44 -3.050 22.912 -5.708 1.00 3.23 C ATOM 662 CG LYS A 44 -3.932 24.104 -5.378 1.00 61.11 C ATOM 663 CD LYS A 44 -5.375 23.684 -5.156 1.00 13.54 C ATOM 664 CE LYS A 44 -5.923 22.918 -6.349 1.00 74.15 C ATOM 665 NZ LYS A 44 -6.044 23.782 -7.556 1.00 1.41 N ATOM 0 H LYS A 44 -1.002 21.777 -6.473 1.00 74.15 H new ATOM 0 HA LYS A 44 -3.460 22.276 -7.721 1.00 21.21 H new ATOM 0 HB2 LYS A 44 -3.564 21.997 -5.412 1.00 3.23 H new ATOM 0 HB3 LYS A 44 -2.137 22.971 -5.115 1.00 3.23 H new ATOM 0 HG2 LYS A 44 -3.555 24.601 -4.484 1.00 61.11 H new ATOM 0 HG3 LYS A 44 -3.884 24.830 -6.190 1.00 61.11 H new ATOM 0 HD2 LYS A 44 -5.441 23.063 -4.263 1.00 13.54 H new ATOM 0 HD3 LYS A 44 -5.988 24.567 -4.977 1.00 13.54 H new ATOM 0 HE2 LYS A 44 -5.269 22.075 -6.570 1.00 74.15 H new ATOM 0 HE3 LYS A 44 -6.900 22.506 -6.098 1.00 74.15 H new ATOM 0 HZ1 LYS A 44 -6.291 23.196 -8.379 1.00 1.41 H new ATOM 0 HZ2 LYS A 44 -6.788 24.492 -7.401 1.00 1.41 H new ATOM 0 HZ3 LYS A 44 -5.138 24.262 -7.732 1.00 1.41 H new ATOM 679 N GLY A 45 -1.361 24.779 -7.743 1.00 31.25 N ATOM 680 CA GLY A 45 -1.143 26.107 -8.285 1.00 12.24 C ATOM 681 C GLY A 45 -1.229 27.187 -7.224 1.00 44.25 C ATOM 682 O GLY A 45 -0.909 28.348 -7.483 1.00 21.31 O ATOM 0 H GLY A 45 -0.533 24.339 -7.342 1.00 31.25 H new ATOM 0 HA2 GLY A 45 -0.163 26.146 -8.760 1.00 12.24 H new ATOM 0 HA3 GLY A 45 -1.882 26.305 -9.062 1.00 12.24 H new ATOM 686 N PHE A 46 -1.663 26.806 -6.028 1.00 1.34 N ATOM 687 CA PHE A 46 -1.792 27.752 -4.925 1.00 33.42 C ATOM 688 C PHE A 46 -2.065 27.022 -3.613 1.00 13.34 C ATOM 689 O PHE A 46 -1.894 25.808 -3.517 1.00 65.12 O ATOM 690 CB PHE A 46 -2.916 28.750 -5.210 1.00 73.20 C ATOM 691 CG PHE A 46 -4.286 28.134 -5.183 1.00 10.15 C ATOM 692 CD1 PHE A 46 -4.754 27.404 -6.263 1.00 44.14 C ATOM 693 CD2 PHE A 46 -5.106 28.285 -4.076 1.00 23.12 C ATOM 694 CE1 PHE A 46 -6.014 26.837 -6.241 1.00 1.32 C ATOM 695 CE2 PHE A 46 -6.367 27.720 -4.047 1.00 41.03 C ATOM 696 CZ PHE A 46 -6.821 26.994 -5.131 1.00 51.30 C ATOM 0 H PHE A 46 -1.931 25.849 -5.797 1.00 1.34 H new ATOM 0 HA PHE A 46 -0.851 28.293 -4.831 1.00 33.42 H new ATOM 0 HB2 PHE A 46 -2.873 29.553 -4.474 1.00 73.20 H new ATOM 0 HB3 PHE A 46 -2.749 29.203 -6.187 1.00 73.20 H new ATOM 0 HD1 PHE A 46 -4.127 27.276 -7.133 1.00 44.14 H new ATOM 0 HD2 PHE A 46 -4.755 28.851 -3.226 1.00 23.12 H new ATOM 0 HE1 PHE A 46 -6.367 26.272 -7.091 1.00 1.32 H new ATOM 0 HE2 PHE A 46 -6.996 27.846 -3.178 1.00 41.03 H new ATOM 0 HZ PHE A 46 -7.805 26.550 -5.111 1.00 51.30 H new ATOM 706 N GLY A 47 -2.491 27.774 -2.602 1.00 55.10 N ATOM 707 CA GLY A 47 -2.781 27.183 -1.308 1.00 42.35 C ATOM 708 C GLY A 47 -2.347 28.068 -0.157 1.00 4.12 C ATOM 709 O GLY A 47 -2.468 29.291 -0.225 1.00 11.53 O ATOM 0 H GLY A 47 -2.640 28.782 -2.656 1.00 55.10 H new ATOM 0 HA2 GLY A 47 -3.851 26.991 -1.231 1.00 42.35 H new ATOM 0 HA3 GLY A 47 -2.278 26.219 -1.231 1.00 42.35 H new ATOM 713 N TYR A 48 -1.841 27.449 0.904 1.00 4.41 N ATOM 714 CA TYR A 48 -1.391 28.189 2.078 1.00 62.34 C ATOM 715 C TYR A 48 0.115 28.036 2.273 1.00 15.35 C ATOM 716 O TYR A 48 0.633 28.230 3.373 1.00 12.43 O ATOM 717 CB TYR A 48 -2.130 27.704 3.326 1.00 54.31 C ATOM 718 CG TYR A 48 -1.757 26.300 3.744 1.00 74.11 C ATOM 719 CD1 TYR A 48 -2.438 25.200 3.237 1.00 32.52 C ATOM 720 CD2 TYR A 48 -0.725 26.073 4.646 1.00 54.11 C ATOM 721 CE1 TYR A 48 -2.102 23.915 3.617 1.00 64.53 C ATOM 722 CE2 TYR A 48 -0.381 24.792 5.030 1.00 61.42 C ATOM 723 CZ TYR A 48 -1.072 23.716 4.513 1.00 60.33 C ATOM 724 OH TYR A 48 -0.733 22.438 4.894 1.00 62.32 O ATOM 0 H TYR A 48 -1.732 26.437 0.976 1.00 4.41 H new ATOM 0 HA TYR A 48 -1.614 29.244 1.919 1.00 62.34 H new ATOM 0 HB2 TYR A 48 -1.921 28.387 4.150 1.00 54.31 H new ATOM 0 HB3 TYR A 48 -3.203 27.746 3.141 1.00 54.31 H new ATOM 0 HD1 TYR A 48 -3.244 25.352 2.534 1.00 32.52 H new ATOM 0 HD2 TYR A 48 -0.182 26.913 5.054 1.00 54.11 H new ATOM 0 HE1 TYR A 48 -2.643 23.071 3.215 1.00 64.53 H new ATOM 0 HE2 TYR A 48 0.425 24.633 5.731 1.00 61.42 H new ATOM 0 HH TYR A 48 -0.063 22.079 4.276 1.00 62.32 H new ATOM 734 N LYS A 49 0.812 27.688 1.198 1.00 61.33 N ATOM 735 CA LYS A 49 2.258 27.510 1.247 1.00 5.44 C ATOM 736 C LYS A 49 2.932 28.715 1.896 1.00 44.41 C ATOM 737 O LYS A 49 2.740 29.852 1.466 1.00 11.14 O ATOM 738 CB LYS A 49 2.816 27.298 -0.162 1.00 13.30 C ATOM 739 CG LYS A 49 4.304 26.994 -0.188 1.00 75.33 C ATOM 740 CD LYS A 49 4.622 25.852 -1.139 1.00 22.34 C ATOM 741 CE LYS A 49 3.989 24.549 -0.676 1.00 75.42 C ATOM 742 NZ LYS A 49 3.066 23.986 -1.701 1.00 65.23 N ATOM 0 H LYS A 49 0.398 27.523 0.280 1.00 61.33 H new ATOM 0 HA LYS A 49 2.470 26.627 1.851 1.00 5.44 H new ATOM 0 HB2 LYS A 49 2.278 26.478 -0.637 1.00 13.30 H new ATOM 0 HB3 LYS A 49 2.626 28.191 -0.757 1.00 13.30 H new ATOM 0 HG2 LYS A 49 4.853 27.885 -0.491 1.00 75.33 H new ATOM 0 HG3 LYS A 49 4.642 26.738 0.816 1.00 75.33 H new ATOM 0 HD2 LYS A 49 4.262 26.098 -2.138 1.00 22.34 H new ATOM 0 HD3 LYS A 49 5.702 25.727 -1.211 1.00 22.34 H new ATOM 0 HE2 LYS A 49 4.772 23.824 -0.454 1.00 75.42 H new ATOM 0 HE3 LYS A 49 3.442 24.720 0.251 1.00 75.42 H new ATOM 0 HZ1 LYS A 49 2.155 23.753 -1.257 1.00 65.23 H new ATOM 0 HZ2 LYS A 49 2.915 24.687 -2.454 1.00 65.23 H new ATOM 0 HZ3 LYS A 49 3.483 23.125 -2.108 1.00 65.23 H new ATOM 756 N GLY A 50 3.725 28.458 2.932 1.00 12.32 N ATOM 757 CA GLY A 50 4.416 29.532 3.622 1.00 61.12 C ATOM 758 C GLY A 50 3.462 30.497 4.297 1.00 75.32 C ATOM 759 O GLY A 50 3.704 31.703 4.324 1.00 11.32 O ATOM 0 H GLY A 50 3.901 27.525 3.306 1.00 12.32 H new ATOM 0 HA2 GLY A 50 5.087 29.107 4.369 1.00 61.12 H new ATOM 0 HA3 GLY A 50 5.036 30.077 2.910 1.00 61.12 H new ATOM 763 N SER A 51 2.372 29.965 4.842 1.00 60.13 N ATOM 764 CA SER A 51 1.374 30.788 5.515 1.00 4.11 C ATOM 765 C SER A 51 1.268 30.414 6.990 1.00 15.04 C ATOM 766 O SER A 51 1.336 29.238 7.350 1.00 11.24 O ATOM 767 CB SER A 51 0.012 30.632 4.838 1.00 73.44 C ATOM 768 OG SER A 51 0.113 30.824 3.437 1.00 2.44 O ATOM 0 H SER A 51 2.158 28.968 4.830 1.00 60.13 H new ATOM 0 HA SER A 51 1.689 31.829 5.443 1.00 4.11 H new ATOM 0 HB2 SER A 51 -0.388 29.639 5.044 1.00 73.44 H new ATOM 0 HB3 SER A 51 -0.690 31.352 5.257 1.00 73.44 H new ATOM 0 HG SER A 51 -0.771 31.035 3.071 1.00 2.44 H new ATOM 774 N CYS A 52 1.100 31.422 7.839 1.00 54.11 N ATOM 775 CA CYS A 52 0.984 31.201 9.276 1.00 71.30 C ATOM 776 C CYS A 52 -0.086 30.157 9.581 1.00 42.21 C ATOM 777 O CYS A 52 -0.837 29.746 8.696 1.00 14.55 O ATOM 778 CB CYS A 52 0.653 32.512 9.990 1.00 73.00 C ATOM 779 SG CYS A 52 -0.931 33.237 9.505 1.00 42.25 S ATOM 0 H CYS A 52 1.041 32.400 7.557 1.00 54.11 H new ATOM 0 HA CYS A 52 1.942 30.830 9.640 1.00 71.30 H new ATOM 0 HB2 CYS A 52 0.646 32.336 11.066 1.00 73.00 H new ATOM 0 HB3 CYS A 52 1.446 33.232 9.791 1.00 73.00 H new ATOM 0 HG CYS A 52 -1.123 34.341 10.164 1.00 42.25 H new ATOM 785 N PHE A 53 -0.148 29.731 10.838 1.00 24.30 N ATOM 786 CA PHE A 53 -1.123 28.733 11.260 1.00 75.44 C ATOM 787 C PHE A 53 -2.431 29.395 11.682 1.00 14.33 C ATOM 788 O PHE A 53 -2.603 30.606 11.535 1.00 72.32 O ATOM 789 CB PHE A 53 -0.565 27.898 12.414 1.00 0.22 C ATOM 790 CG PHE A 53 -0.564 26.421 12.141 1.00 42.32 C ATOM 791 CD1 PHE A 53 0.231 25.890 11.138 1.00 22.54 C ATOM 792 CD2 PHE A 53 -1.358 25.565 12.886 1.00 73.21 C ATOM 793 CE1 PHE A 53 0.235 24.531 10.884 1.00 31.24 C ATOM 794 CE2 PHE A 53 -1.358 24.205 12.637 1.00 54.43 C ATOM 795 CZ PHE A 53 -0.562 23.688 11.634 1.00 22.10 C ATOM 0 H PHE A 53 0.466 30.062 11.582 1.00 24.30 H new ATOM 0 HA PHE A 53 -1.324 28.078 10.412 1.00 75.44 H new ATOM 0 HB2 PHE A 53 0.454 28.221 12.625 1.00 0.22 H new ATOM 0 HB3 PHE A 53 -1.153 28.093 13.311 1.00 0.22 H new ATOM 0 HD1 PHE A 53 0.855 26.545 10.548 1.00 22.54 H new ATOM 0 HD2 PHE A 53 -1.984 25.964 13.670 1.00 73.21 H new ATOM 0 HE1 PHE A 53 0.860 24.129 10.100 1.00 31.24 H new ATOM 0 HE2 PHE A 53 -1.980 23.548 13.226 1.00 54.43 H new ATOM 0 HZ PHE A 53 -0.563 22.626 11.436 1.00 22.10 H new ATOM 805 N HIS A 54 -3.351 28.593 12.208 1.00 35.12 N ATOM 806 CA HIS A 54 -4.645 29.101 12.653 1.00 64.53 C ATOM 807 C HIS A 54 -4.718 29.139 14.176 1.00 15.32 C ATOM 808 O HIS A 54 -4.730 30.212 14.779 1.00 10.45 O ATOM 809 CB HIS A 54 -5.775 28.233 12.098 1.00 41.34 C ATOM 810 CG HIS A 54 -7.107 28.918 12.089 1.00 3.45 C ATOM 811 ND1 HIS A 54 -8.304 28.236 12.131 1.00 13.04 N ATOM 812 CD2 HIS A 54 -7.426 30.233 12.046 1.00 42.03 C ATOM 813 CE1 HIS A 54 -9.302 29.101 12.112 1.00 53.31 C ATOM 814 NE2 HIS A 54 -8.796 30.320 12.060 1.00 12.25 N ATOM 0 H HIS A 54 -3.225 27.589 12.337 1.00 35.12 H new ATOM 0 HA HIS A 54 -4.759 30.117 12.276 1.00 64.53 H new ATOM 0 HB2 HIS A 54 -5.524 27.931 11.081 1.00 41.34 H new ATOM 0 HB3 HIS A 54 -5.848 27.322 12.692 1.00 41.34 H new ATOM 0 HD2 HIS A 54 -6.732 31.060 12.008 1.00 42.03 H new ATOM 0 HE1 HIS A 54 -10.353 28.854 12.135 1.00 53.31 H new ATOM 0 HE2 HIS A 54 -9.335 31.185 12.034 1.00 12.25 H new ATOM 822 N ARG A 55 -4.769 27.962 14.791 1.00 11.45 N ATOM 823 CA ARG A 55 -4.844 27.862 16.244 1.00 10.40 C ATOM 824 C ARG A 55 -3.920 26.764 16.762 1.00 71.23 C ATOM 825 O ARG A 55 -3.512 25.878 16.010 1.00 20.45 O ATOM 826 CB ARG A 55 -6.282 27.583 16.684 1.00 54.12 C ATOM 827 CG ARG A 55 -6.511 27.770 18.175 1.00 44.12 C ATOM 828 CD ARG A 55 -7.975 27.585 18.542 1.00 43.22 C ATOM 829 NE ARG A 55 -8.861 28.319 17.642 1.00 33.34 N ATOM 830 CZ ARG A 55 -9.105 29.620 17.751 1.00 60.04 C ATOM 831 NH1 ARG A 55 -8.531 30.327 18.714 1.00 12.40 N ATOM 832 NH2 ARG A 55 -9.924 30.216 16.894 1.00 42.34 N ATOM 0 H ARG A 55 -4.760 27.065 14.306 1.00 11.45 H new ATOM 0 HA ARG A 55 -4.521 28.814 16.665 1.00 10.40 H new ATOM 0 HB2 ARG A 55 -6.955 28.243 16.136 1.00 54.12 H new ATOM 0 HB3 ARG A 55 -6.545 26.561 16.410 1.00 54.12 H new ATOM 0 HG2 ARG A 55 -5.903 27.056 18.730 1.00 44.12 H new ATOM 0 HG3 ARG A 55 -6.183 28.766 18.472 1.00 44.12 H new ATOM 0 HD2 ARG A 55 -8.225 26.525 18.512 1.00 43.22 H new ATOM 0 HD3 ARG A 55 -8.138 27.922 19.566 1.00 43.22 H new ATOM 0 HE ARG A 55 -9.317 27.804 16.889 1.00 33.34 H new ATOM 0 HH11 ARG A 55 -7.900 29.872 19.374 1.00 12.40 H new ATOM 0 HH12 ARG A 55 -8.720 31.326 18.795 1.00 12.40 H new ATOM 0 HH21 ARG A 55 -10.367 29.675 16.151 1.00 42.34 H new ATOM 0 HH22 ARG A 55 -10.111 31.215 16.978 1.00 42.34 H new ATOM 846 N ILE A 56 -3.594 26.829 18.048 1.00 15.32 N ATOM 847 CA ILE A 56 -2.720 25.840 18.666 1.00 44.35 C ATOM 848 C ILE A 56 -3.080 25.627 20.132 1.00 71.53 C ATOM 849 O ILE A 56 -2.817 26.482 20.977 1.00 2.21 O ATOM 850 CB ILE A 56 -1.240 26.258 18.568 1.00 75.02 C ATOM 851 CG1 ILE A 56 -0.714 26.024 17.150 1.00 34.43 C ATOM 852 CG2 ILE A 56 -0.405 25.491 19.582 1.00 34.11 C ATOM 853 CD1 ILE A 56 0.688 26.547 16.932 1.00 10.10 C ATOM 0 H ILE A 56 -3.922 27.557 18.683 1.00 15.32 H new ATOM 0 HA ILE A 56 -2.863 24.907 18.120 1.00 44.35 H new ATOM 0 HB ILE A 56 -1.162 27.322 18.793 1.00 75.02 H new ATOM 0 HG12 ILE A 56 -0.732 24.955 16.936 1.00 34.43 H new ATOM 0 HG13 ILE A 56 -1.386 26.503 16.438 1.00 34.43 H new ATOM 0 HG21 ILE A 56 0.638 25.797 19.501 1.00 34.11 H new ATOM 0 HG22 ILE A 56 -0.768 25.704 20.588 1.00 34.11 H new ATOM 0 HG23 ILE A 56 -0.486 24.422 19.386 1.00 34.11 H new ATOM 0 HD11 ILE A 56 0.996 26.347 15.906 1.00 10.10 H new ATOM 0 HD12 ILE A 56 0.708 27.622 17.114 1.00 10.10 H new ATOM 0 HD13 ILE A 56 1.373 26.050 17.619 1.00 10.10 H new ATOM 865 N ILE A 57 -3.682 24.479 20.426 1.00 10.10 N ATOM 866 CA ILE A 57 -4.076 24.152 21.791 1.00 63.43 C ATOM 867 C ILE A 57 -3.150 23.099 22.392 1.00 15.32 C ATOM 868 O ILE A 57 -3.226 21.913 22.070 1.00 13.34 O ATOM 869 CB ILE A 57 -5.526 23.638 21.850 1.00 34.13 C ATOM 870 CG1 ILE A 57 -6.487 24.692 21.296 1.00 0.34 C ATOM 871 CG2 ILE A 57 -5.900 23.271 23.279 1.00 52.23 C ATOM 872 CD1 ILE A 57 -7.762 24.109 20.728 1.00 45.14 C ATOM 0 H ILE A 57 -3.907 23.761 19.738 1.00 10.10 H new ATOM 0 HA ILE A 57 -4.002 25.072 22.371 1.00 63.43 H new ATOM 0 HB ILE A 57 -5.604 22.743 21.233 1.00 34.13 H new ATOM 0 HG12 ILE A 57 -6.741 25.394 22.090 1.00 0.34 H new ATOM 0 HG13 ILE A 57 -5.979 25.261 20.518 1.00 0.34 H new ATOM 0 HG21 ILE A 57 -6.928 22.909 23.305 1.00 52.23 H new ATOM 0 HG22 ILE A 57 -5.231 22.490 23.641 1.00 52.23 H new ATOM 0 HG23 ILE A 57 -5.809 24.151 23.916 1.00 52.23 H new ATOM 0 HD11 ILE A 57 -8.395 24.914 20.354 1.00 45.14 H new ATOM 0 HD12 ILE A 57 -7.519 23.429 19.912 1.00 45.14 H new ATOM 0 HD13 ILE A 57 -8.292 23.564 21.509 1.00 45.14 H new ATOM 884 N PRO A 58 -2.256 23.541 23.289 1.00 60.22 N ATOM 885 CA PRO A 58 -1.300 22.653 23.957 1.00 60.43 C ATOM 886 C PRO A 58 -1.977 21.713 24.949 1.00 50.22 C ATOM 887 O PRO A 58 -1.955 21.949 26.156 1.00 14.20 O ATOM 888 CB PRO A 58 -0.367 23.621 24.688 1.00 14.14 C ATOM 889 CG PRO A 58 -1.187 24.846 24.904 1.00 11.20 C ATOM 890 CD PRO A 58 -2.109 24.941 23.720 1.00 13.11 C ATOM 0 HA PRO A 58 -0.789 21.999 23.250 1.00 60.43 H new ATOM 0 HB2 PRO A 58 -0.024 23.202 25.634 1.00 14.14 H new ATOM 0 HB3 PRO A 58 0.521 23.839 24.095 1.00 14.14 H new ATOM 0 HG2 PRO A 58 -1.752 24.779 25.834 1.00 11.20 H new ATOM 0 HG3 PRO A 58 -0.555 25.731 24.978 1.00 11.20 H new ATOM 0 HD2 PRO A 58 -3.069 25.381 23.992 1.00 13.11 H new ATOM 0 HD3 PRO A 58 -1.686 25.562 22.930 1.00 13.11 H new ATOM 898 N GLY A 59 -2.578 20.646 24.431 1.00 21.01 N ATOM 899 CA GLY A 59 -3.253 19.687 25.286 1.00 24.21 C ATOM 900 C GLY A 59 -4.232 18.818 24.522 1.00 14.25 C ATOM 901 O GLY A 59 -4.520 17.692 24.927 1.00 75.40 O ATOM 0 H GLY A 59 -2.609 20.429 23.435 1.00 21.01 H new ATOM 0 HA2 GLY A 59 -2.511 19.053 25.772 1.00 24.21 H new ATOM 0 HA3 GLY A 59 -3.784 20.219 26.076 1.00 24.21 H new ATOM 905 N PHE A 60 -4.748 19.343 23.415 1.00 24.45 N ATOM 906 CA PHE A 60 -5.703 18.608 22.595 1.00 54.34 C ATOM 907 C PHE A 60 -5.173 18.424 21.176 1.00 70.02 C ATOM 908 O PHE A 60 -5.017 17.299 20.701 1.00 11.24 O ATOM 909 CB PHE A 60 -7.046 19.341 22.558 1.00 2.52 C ATOM 910 CG PHE A 60 -8.196 18.510 23.050 1.00 53.42 C ATOM 911 CD1 PHE A 60 -8.095 17.794 24.231 1.00 34.14 C ATOM 912 CD2 PHE A 60 -9.379 18.446 22.331 1.00 42.14 C ATOM 913 CE1 PHE A 60 -9.152 17.028 24.685 1.00 33.25 C ATOM 914 CE2 PHE A 60 -10.439 17.682 22.780 1.00 74.10 C ATOM 915 CZ PHE A 60 -10.326 16.973 23.960 1.00 71.34 C ATOM 0 H PHE A 60 -4.521 20.274 23.066 1.00 24.45 H new ATOM 0 HA PHE A 60 -5.846 17.624 23.042 1.00 54.34 H new ATOM 0 HB2 PHE A 60 -6.975 20.244 23.165 1.00 2.52 H new ATOM 0 HB3 PHE A 60 -7.249 19.659 21.535 1.00 2.52 H new ATOM 0 HD1 PHE A 60 -7.180 17.835 24.804 1.00 34.14 H new ATOM 0 HD2 PHE A 60 -9.473 19.000 21.409 1.00 42.14 H new ATOM 0 HE1 PHE A 60 -9.060 16.473 25.607 1.00 33.25 H new ATOM 0 HE2 PHE A 60 -11.355 17.639 22.209 1.00 74.10 H new ATOM 0 HZ PHE A 60 -11.154 16.377 24.315 1.00 71.34 H new ATOM 925 N MET A 61 -4.898 19.537 20.504 1.00 53.30 N ATOM 926 CA MET A 61 -4.385 19.499 19.140 1.00 41.05 C ATOM 927 C MET A 61 -4.367 20.896 18.526 1.00 31.51 C ATOM 928 O MET A 61 -5.113 21.779 18.950 1.00 4.42 O ATOM 929 CB MET A 61 -5.234 18.562 18.279 1.00 61.25 C ATOM 930 CG MET A 61 -6.728 18.819 18.392 1.00 22.20 C ATOM 931 SD MET A 61 -7.327 19.987 17.157 1.00 54.43 S ATOM 932 CE MET A 61 -7.988 21.280 18.206 1.00 73.21 C ATOM 0 H MET A 61 -5.022 20.476 20.882 1.00 53.30 H new ATOM 0 HA MET A 61 -3.362 19.123 19.174 1.00 41.05 H new ATOM 0 HB2 MET A 61 -4.933 18.668 17.237 1.00 61.25 H new ATOM 0 HB3 MET A 61 -5.028 17.531 18.567 1.00 61.25 H new ATOM 0 HG2 MET A 61 -7.264 17.876 18.285 1.00 22.20 H new ATOM 0 HG3 MET A 61 -6.953 19.202 19.388 1.00 22.20 H new ATOM 0 HE1 MET A 61 -9.076 21.286 18.135 1.00 73.21 H new ATOM 0 HE2 MET A 61 -7.693 21.097 19.239 1.00 73.21 H new ATOM 0 HE3 MET A 61 -7.598 22.245 17.883 1.00 73.21 H new ATOM 942 N CYS A 62 -3.512 21.087 17.527 1.00 15.14 N ATOM 943 CA CYS A 62 -3.397 22.377 16.857 1.00 53.25 C ATOM 944 C CYS A 62 -4.428 22.503 15.739 1.00 21.22 C ATOM 945 O CYS A 62 -5.364 21.709 15.654 1.00 15.15 O ATOM 946 CB CYS A 62 -1.988 22.557 16.290 1.00 72.43 C ATOM 947 SG CYS A 62 -0.670 22.032 17.410 1.00 5.31 S ATOM 0 H CYS A 62 -2.889 20.366 17.164 1.00 15.14 H new ATOM 0 HA CYS A 62 -3.587 23.159 17.592 1.00 53.25 H new ATOM 0 HB2 CYS A 62 -1.907 21.993 15.361 1.00 72.43 H new ATOM 0 HB3 CYS A 62 -1.840 23.607 16.039 1.00 72.43 H new ATOM 0 HG CYS A 62 0.451 21.959 16.756 1.00 5.31 H new ATOM 953 N GLN A 63 -4.248 23.506 14.886 1.00 75.11 N ATOM 954 CA GLN A 63 -5.165 23.736 13.775 1.00 3.53 C ATOM 955 C GLN A 63 -4.533 24.648 12.729 1.00 41.33 C ATOM 956 O GLN A 63 -4.200 25.798 13.012 1.00 12.22 O ATOM 957 CB GLN A 63 -6.470 24.351 14.283 1.00 74.02 C ATOM 958 CG GLN A 63 -7.652 24.120 13.355 1.00 13.31 C ATOM 959 CD GLN A 63 -8.985 24.342 14.042 1.00 14.01 C ATOM 960 OE1 GLN A 63 -9.296 23.695 15.043 1.00 52.51 O ATOM 961 NE2 GLN A 63 -9.782 25.260 13.507 1.00 1.02 N ATOM 0 H GLN A 63 -3.477 24.172 14.942 1.00 75.11 H new ATOM 0 HA GLN A 63 -5.382 22.774 13.310 1.00 3.53 H new ATOM 0 HB2 GLN A 63 -6.701 23.934 15.263 1.00 74.02 H new ATOM 0 HB3 GLN A 63 -6.329 25.423 14.418 1.00 74.02 H new ATOM 0 HG2 GLN A 63 -7.573 24.790 12.499 1.00 13.31 H new ATOM 0 HG3 GLN A 63 -7.612 23.102 12.968 1.00 13.31 H new ATOM 0 HE21 GLN A 63 -9.484 25.773 12.677 1.00 1.02 H new ATOM 0 HE22 GLN A 63 -10.692 25.452 13.926 1.00 1.02 H new ATOM 970 N GLY A 64 -4.370 24.126 11.517 1.00 50.24 N ATOM 971 CA GLY A 64 -3.778 24.907 10.446 1.00 21.21 C ATOM 972 C GLY A 64 -4.738 25.932 9.877 1.00 52.31 C ATOM 973 O GLY A 64 -5.941 25.875 10.131 1.00 5.51 O ATOM 0 H GLY A 64 -4.637 23.176 11.258 1.00 50.24 H new ATOM 0 HA2 GLY A 64 -2.889 25.415 10.820 1.00 21.21 H new ATOM 0 HA3 GLY A 64 -3.452 24.238 9.650 1.00 21.21 H new ATOM 1153 N ILE A 78 -9.621 21.063 -2.653 1.00 4.43 N ATOM 1154 CA ILE A 78 -9.395 21.159 -4.090 1.00 1.35 C ATOM 1155 C ILE A 78 -10.521 20.488 -4.869 1.00 3.01 C ATOM 1156 O ILE A 78 -10.306 19.962 -5.961 1.00 62.11 O ATOM 1157 CB ILE A 78 -8.054 20.519 -4.493 1.00 24.43 C ATOM 1158 CG1 ILE A 78 -8.128 18.997 -4.352 1.00 62.25 C ATOM 1159 CG2 ILE A 78 -6.922 21.080 -3.644 1.00 74.30 C ATOM 1160 CD1 ILE A 78 -7.062 18.265 -5.137 1.00 44.02 C ATOM 0 HA ILE A 78 -9.369 22.221 -4.335 1.00 1.35 H new ATOM 0 HB ILE A 78 -7.853 20.760 -5.537 1.00 24.43 H new ATOM 0 HG12 ILE A 78 -8.038 18.733 -3.298 1.00 62.25 H new ATOM 0 HG13 ILE A 78 -9.109 18.657 -4.683 1.00 62.25 H new ATOM 0 HG21 ILE A 78 -5.981 20.618 -3.941 1.00 74.30 H new ATOM 0 HG22 ILE A 78 -6.858 22.158 -3.789 1.00 74.30 H new ATOM 0 HG23 ILE A 78 -7.115 20.866 -2.593 1.00 74.30 H new ATOM 0 HD11 ILE A 78 -7.175 17.191 -4.990 1.00 44.02 H new ATOM 0 HD12 ILE A 78 -7.165 18.499 -6.197 1.00 44.02 H new ATOM 0 HD13 ILE A 78 -6.077 18.577 -4.791 1.00 44.02 H new ATOM 1172 N TYR A 79 -11.721 20.512 -4.301 1.00 73.43 N ATOM 1173 CA TYR A 79 -12.882 19.905 -4.942 1.00 61.23 C ATOM 1174 C TYR A 79 -13.943 20.956 -5.256 1.00 23.44 C ATOM 1175 O TYR A 79 -15.132 20.651 -5.329 1.00 72.43 O ATOM 1176 CB TYR A 79 -13.475 18.817 -4.046 1.00 30.41 C ATOM 1177 CG TYR A 79 -13.532 17.456 -4.702 1.00 63.33 C ATOM 1178 CD1 TYR A 79 -14.480 17.171 -5.677 1.00 15.24 C ATOM 1179 CD2 TYR A 79 -12.635 16.454 -4.349 1.00 14.43 C ATOM 1180 CE1 TYR A 79 -14.536 15.929 -6.278 1.00 72.02 C ATOM 1181 CE2 TYR A 79 -12.683 15.210 -4.946 1.00 62.32 C ATOM 1182 CZ TYR A 79 -13.635 14.952 -5.910 1.00 33.31 C ATOM 1183 OH TYR A 79 -13.687 13.713 -6.508 1.00 4.41 O ATOM 0 H TYR A 79 -11.916 20.945 -3.398 1.00 73.43 H new ATOM 0 HA TYR A 79 -12.554 19.455 -5.879 1.00 61.23 H new ATOM 0 HB2 TYR A 79 -12.883 18.747 -3.134 1.00 30.41 H new ATOM 0 HB3 TYR A 79 -14.482 19.111 -3.750 1.00 30.41 H new ATOM 0 HD1 TYR A 79 -15.186 17.934 -5.970 1.00 15.24 H new ATOM 0 HD2 TYR A 79 -11.888 16.652 -3.595 1.00 14.43 H new ATOM 0 HE1 TYR A 79 -15.281 15.724 -7.032 1.00 72.02 H new ATOM 0 HE2 TYR A 79 -11.979 14.443 -4.660 1.00 62.32 H new ATOM 0 HH TYR A 79 -12.837 13.532 -6.961 1.00 4.41 H new ATOM 1193 N GLY A 80 -13.501 22.196 -5.440 1.00 13.32 N ATOM 1194 CA GLY A 80 -14.424 23.274 -5.744 1.00 0.45 C ATOM 1195 C GLY A 80 -14.940 23.964 -4.497 1.00 12.45 C ATOM 1196 O GLY A 80 -14.591 25.113 -4.226 1.00 32.10 O ATOM 0 H GLY A 80 -12.521 22.473 -5.384 1.00 13.32 H new ATOM 0 HA2 GLY A 80 -13.926 24.005 -6.381 1.00 0.45 H new ATOM 0 HA3 GLY A 80 -15.266 22.878 -6.311 1.00 0.45 H new ATOM 1200 N GLU A 81 -15.775 23.263 -3.736 1.00 71.33 N ATOM 1201 CA GLU A 81 -16.342 23.817 -2.513 1.00 10.15 C ATOM 1202 C GLU A 81 -16.065 22.904 -1.322 1.00 61.51 C ATOM 1203 O GLU A 81 -15.485 23.327 -0.321 1.00 74.55 O ATOM 1204 CB GLU A 81 -17.850 24.024 -2.671 1.00 22.24 C ATOM 1205 CG GLU A 81 -18.243 24.649 -3.999 1.00 24.33 C ATOM 1206 CD GLU A 81 -17.791 26.091 -4.121 1.00 40.11 C ATOM 1207 OE1 GLU A 81 -17.320 26.652 -3.110 1.00 11.44 O ATOM 1208 OE2 GLU A 81 -17.908 26.658 -5.227 1.00 54.42 O ATOM 0 H GLU A 81 -16.073 22.310 -3.945 1.00 71.33 H new ATOM 0 HA GLU A 81 -15.868 24.781 -2.328 1.00 10.15 H new ATOM 0 HB2 GLU A 81 -18.353 23.062 -2.569 1.00 22.24 H new ATOM 0 HB3 GLU A 81 -18.208 24.659 -1.860 1.00 22.24 H new ATOM 0 HG2 GLU A 81 -17.811 24.067 -4.813 1.00 24.33 H new ATOM 0 HG3 GLU A 81 -19.326 24.601 -4.113 1.00 24.33 H new ATOM 1215 N LYS A 82 -16.484 21.648 -1.437 1.00 64.24 N ATOM 1216 CA LYS A 82 -16.281 20.672 -0.373 1.00 11.32 C ATOM 1217 C LYS A 82 -16.955 19.347 -0.714 1.00 23.01 C ATOM 1218 O LYS A 82 -17.551 19.199 -1.781 1.00 32.23 O ATOM 1219 CB LYS A 82 -16.830 21.210 0.951 1.00 72.13 C ATOM 1220 CG LYS A 82 -18.164 21.923 0.811 1.00 31.20 C ATOM 1221 CD LYS A 82 -19.255 20.977 0.338 1.00 31.20 C ATOM 1222 CE LYS A 82 -19.665 21.272 -1.097 1.00 32.23 C ATOM 1223 NZ LYS A 82 -20.793 20.406 -1.540 1.00 44.15 N ATOM 0 H LYS A 82 -16.967 21.282 -2.258 1.00 64.24 H new ATOM 0 HA LYS A 82 -15.210 20.499 -0.272 1.00 11.32 H new ATOM 0 HB2 LYS A 82 -16.942 20.382 1.652 1.00 72.13 H new ATOM 0 HB3 LYS A 82 -16.103 21.898 1.383 1.00 72.13 H new ATOM 0 HG2 LYS A 82 -18.448 22.357 1.770 1.00 31.20 H new ATOM 0 HG3 LYS A 82 -18.065 22.747 0.105 1.00 31.20 H new ATOM 0 HD2 LYS A 82 -18.903 19.948 0.413 1.00 31.20 H new ATOM 0 HD3 LYS A 82 -20.123 21.066 0.991 1.00 31.20 H new ATOM 0 HE2 LYS A 82 -19.955 22.319 -1.184 1.00 32.23 H new ATOM 0 HE3 LYS A 82 -18.811 21.122 -1.757 1.00 32.23 H new ATOM 0 HZ1 LYS A 82 -21.043 20.637 -2.523 1.00 44.15 H new ATOM 0 HZ2 LYS A 82 -20.508 19.408 -1.481 1.00 44.15 H new ATOM 0 HZ3 LYS A 82 -21.617 20.568 -0.926 1.00 44.15 H new ATOM 1237 N PHE A 83 -16.857 18.386 0.199 1.00 3.42 N ATOM 1238 CA PHE A 83 -17.457 17.073 -0.005 1.00 51.31 C ATOM 1239 C PHE A 83 -17.947 16.488 1.316 1.00 21.31 C ATOM 1240 O PHE A 83 -17.810 17.108 2.370 1.00 41.01 O ATOM 1241 CB PHE A 83 -16.449 16.123 -0.654 1.00 44.33 C ATOM 1242 CG PHE A 83 -15.226 15.883 0.184 1.00 21.34 C ATOM 1243 CD1 PHE A 83 -14.325 16.907 0.429 1.00 33.23 C ATOM 1244 CD2 PHE A 83 -14.978 14.633 0.728 1.00 25.12 C ATOM 1245 CE1 PHE A 83 -13.199 16.688 1.200 1.00 72.20 C ATOM 1246 CE2 PHE A 83 -13.853 14.408 1.500 1.00 32.01 C ATOM 1247 CZ PHE A 83 -12.963 15.437 1.737 1.00 14.30 C ATOM 0 H PHE A 83 -16.368 18.492 1.088 1.00 3.42 H new ATOM 0 HA PHE A 83 -18.313 17.192 -0.669 1.00 51.31 H new ATOM 0 HB2 PHE A 83 -16.937 15.169 -0.852 1.00 44.33 H new ATOM 0 HB3 PHE A 83 -16.145 16.532 -1.618 1.00 44.33 H new ATOM 0 HD1 PHE A 83 -14.505 17.887 0.013 1.00 33.23 H new ATOM 0 HD2 PHE A 83 -15.671 13.825 0.547 1.00 25.12 H new ATOM 0 HE1 PHE A 83 -12.504 17.494 1.383 1.00 72.20 H new ATOM 0 HE2 PHE A 83 -13.671 13.429 1.917 1.00 32.01 H new ATOM 0 HZ PHE A 83 -12.084 15.264 2.341 1.00 14.30 H new ATOM 1257 N GLU A 84 -18.519 15.289 1.250 1.00 42.53 N ATOM 1258 CA GLU A 84 -19.030 14.621 2.440 1.00 34.13 C ATOM 1259 C GLU A 84 -18.018 13.612 2.975 1.00 0.11 C ATOM 1260 O GLU A 84 -17.051 13.268 2.296 1.00 64.21 O ATOM 1261 CB GLU A 84 -20.353 13.917 2.128 1.00 24.35 C ATOM 1262 CG GLU A 84 -20.223 12.808 1.098 1.00 73.22 C ATOM 1263 CD GLU A 84 -20.801 13.194 -0.250 1.00 34.31 C ATOM 1264 OE1 GLU A 84 -22.022 13.019 -0.444 1.00 54.13 O ATOM 1265 OE2 GLU A 84 -20.032 13.671 -1.110 1.00 61.22 O ATOM 0 H GLU A 84 -18.640 14.762 0.385 1.00 42.53 H new ATOM 0 HA GLU A 84 -19.201 15.378 3.205 1.00 34.13 H new ATOM 0 HB2 GLU A 84 -20.759 13.500 3.049 1.00 24.35 H new ATOM 0 HB3 GLU A 84 -21.071 14.654 1.768 1.00 24.35 H new ATOM 0 HG2 GLU A 84 -19.171 12.550 0.978 1.00 73.22 H new ATOM 0 HG3 GLU A 84 -20.730 11.915 1.465 1.00 73.22 H new ATOM 1272 N ASP A 85 -18.248 13.143 4.196 1.00 0.05 N ATOM 1273 CA ASP A 85 -17.357 12.173 4.823 1.00 12.44 C ATOM 1274 C ASP A 85 -16.995 11.058 3.848 1.00 73.20 C ATOM 1275 O ASP A 85 -17.792 10.695 2.983 1.00 23.32 O ATOM 1276 CB ASP A 85 -18.011 11.583 6.074 1.00 64.43 C ATOM 1277 CG ASP A 85 -17.348 10.294 6.519 1.00 3.15 C ATOM 1278 OD1 ASP A 85 -16.198 10.355 7.002 1.00 2.22 O ATOM 1279 OD2 ASP A 85 -17.978 9.224 6.385 1.00 54.41 O ATOM 0 H ASP A 85 -19.044 13.418 4.772 1.00 0.05 H new ATOM 0 HA ASP A 85 -16.441 12.690 5.111 1.00 12.44 H new ATOM 0 HB2 ASP A 85 -17.963 12.311 6.884 1.00 64.43 H new ATOM 0 HB3 ASP A 85 -19.066 11.396 5.875 1.00 64.43 H new ATOM 1284 N GLU A 86 -15.788 10.520 3.994 1.00 75.45 N ATOM 1285 CA GLU A 86 -15.321 9.447 3.123 1.00 32.25 C ATOM 1286 C GLU A 86 -15.278 8.118 3.873 1.00 4.31 C ATOM 1287 O GLU A 86 -16.127 7.252 3.671 1.00 21.41 O ATOM 1288 CB GLU A 86 -13.934 9.778 2.569 1.00 72.44 C ATOM 1289 CG GLU A 86 -13.360 8.689 1.677 1.00 2.41 C ATOM 1290 CD GLU A 86 -14.205 8.439 0.443 1.00 12.43 C ATOM 1291 OE1 GLU A 86 -14.910 9.373 0.007 1.00 43.31 O ATOM 1292 OE2 GLU A 86 -14.161 7.309 -0.086 1.00 35.12 O ATOM 0 H GLU A 86 -15.117 10.809 4.706 1.00 75.45 H new ATOM 0 HA GLU A 86 -16.023 9.354 2.294 1.00 32.25 H new ATOM 0 HB2 GLU A 86 -13.990 10.708 2.003 1.00 72.44 H new ATOM 0 HB3 GLU A 86 -13.252 9.952 3.401 1.00 72.44 H new ATOM 0 HG2 GLU A 86 -12.352 8.969 1.372 1.00 2.41 H new ATOM 0 HG3 GLU A 86 -13.275 7.764 2.248 1.00 2.41 H new ATOM 1299 N ASN A 87 -14.281 7.967 4.739 1.00 63.41 N ATOM 1300 CA ASN A 87 -14.125 6.744 5.518 1.00 23.13 C ATOM 1301 C ASN A 87 -13.211 6.976 6.718 1.00 43.14 C ATOM 1302 O ASN A 87 -12.574 8.024 6.833 1.00 70.41 O ATOM 1303 CB ASN A 87 -13.560 5.624 4.642 1.00 50.12 C ATOM 1304 CG ASN A 87 -12.299 6.043 3.910 1.00 32.43 C ATOM 1305 OD1 ASN A 87 -11.643 7.014 4.287 1.00 54.14 O ATOM 1306 ND2 ASN A 87 -11.955 5.309 2.858 1.00 24.14 N ATOM 0 H ASN A 87 -13.570 8.676 4.919 1.00 63.41 H new ATOM 0 HA ASN A 87 -15.108 6.449 5.884 1.00 23.13 H new ATOM 0 HB2 ASN A 87 -13.345 4.754 5.263 1.00 50.12 H new ATOM 0 HB3 ASN A 87 -14.314 5.319 3.916 1.00 50.12 H new ATOM 0 HD21 ASN A 87 -11.116 5.542 2.326 1.00 24.14 H new ATOM 0 HD22 ASN A 87 -12.529 4.513 2.582 1.00 24.14 H new ATOM 1313 N PHE A 88 -13.150 5.992 7.608 1.00 34.41 N ATOM 1314 CA PHE A 88 -12.315 6.088 8.799 1.00 3.22 C ATOM 1315 C PHE A 88 -11.466 4.832 8.972 1.00 75.42 C ATOM 1316 O PHE A 88 -11.256 4.361 10.090 1.00 32.20 O ATOM 1317 CB PHE A 88 -13.182 6.306 10.041 1.00 73.14 C ATOM 1318 CG PHE A 88 -14.592 6.716 9.722 1.00 21.44 C ATOM 1319 CD1 PHE A 88 -15.558 5.763 9.444 1.00 73.41 C ATOM 1320 CD2 PHE A 88 -14.950 8.054 9.701 1.00 34.22 C ATOM 1321 CE1 PHE A 88 -16.856 6.136 9.151 1.00 15.10 C ATOM 1322 CE2 PHE A 88 -16.247 8.433 9.410 1.00 41.35 C ATOM 1323 CZ PHE A 88 -17.201 7.473 9.133 1.00 42.41 C ATOM 0 H PHE A 88 -13.669 5.118 7.527 1.00 34.41 H new ATOM 0 HA PHE A 88 -11.648 6.942 8.676 1.00 3.22 H new ATOM 0 HB2 PHE A 88 -13.203 5.387 10.626 1.00 73.14 H new ATOM 0 HB3 PHE A 88 -12.722 7.071 10.666 1.00 73.14 H new ATOM 0 HD1 PHE A 88 -15.294 4.716 9.456 1.00 73.41 H new ATOM 0 HD2 PHE A 88 -14.208 8.809 9.914 1.00 34.22 H new ATOM 0 HE1 PHE A 88 -17.600 5.383 8.936 1.00 15.10 H new ATOM 0 HE2 PHE A 88 -16.515 9.479 9.399 1.00 41.35 H new ATOM 0 HZ PHE A 88 -18.214 7.767 8.903 1.00 42.41 H new ATOM 1333 N ILE A 89 -10.983 4.294 7.857 1.00 21.21 N ATOM 1334 CA ILE A 89 -10.158 3.093 7.885 1.00 64.34 C ATOM 1335 C ILE A 89 -9.019 3.231 8.890 1.00 34.30 C ATOM 1336 O ILE A 89 -8.568 2.244 9.473 1.00 61.12 O ATOM 1337 CB ILE A 89 -9.567 2.784 6.496 1.00 24.24 C ATOM 1338 CG1 ILE A 89 -10.668 2.797 5.435 1.00 73.14 C ATOM 1339 CG2 ILE A 89 -8.854 1.440 6.511 1.00 22.23 C ATOM 1340 CD1 ILE A 89 -10.340 1.968 4.213 1.00 61.31 C ATOM 0 H ILE A 89 -11.149 4.671 6.924 1.00 21.21 H new ATOM 0 HA ILE A 89 -10.807 2.271 8.186 1.00 64.34 H new ATOM 0 HB ILE A 89 -8.840 3.557 6.247 1.00 24.24 H new ATOM 0 HG12 ILE A 89 -11.592 2.426 5.878 1.00 73.14 H new ATOM 0 HG13 ILE A 89 -10.852 3.826 5.127 1.00 73.14 H new ATOM 0 HG21 ILE A 89 -8.442 1.236 5.523 1.00 22.23 H new ATOM 0 HG22 ILE A 89 -8.047 1.465 7.243 1.00 22.23 H new ATOM 0 HG23 ILE A 89 -9.562 0.655 6.778 1.00 22.23 H new ATOM 0 HD11 ILE A 89 -11.165 2.024 3.503 1.00 61.31 H new ATOM 0 HD12 ILE A 89 -9.433 2.352 3.746 1.00 61.31 H new ATOM 0 HD13 ILE A 89 -10.185 0.930 4.508 1.00 61.31 H new ATOM 1352 N LEU A 90 -8.560 4.461 9.090 1.00 14.13 N ATOM 1353 CA LEU A 90 -7.475 4.730 10.028 1.00 73.15 C ATOM 1354 C LEU A 90 -7.988 5.479 11.254 1.00 63.53 C ATOM 1355 O LEU A 90 -7.918 6.706 11.320 1.00 65.04 O ATOM 1356 CB LEU A 90 -6.374 5.542 9.344 1.00 63.52 C ATOM 1357 CG LEU A 90 -5.824 4.962 8.040 1.00 50.02 C ATOM 1358 CD1 LEU A 90 -5.158 6.049 7.212 1.00 45.45 C ATOM 1359 CD2 LEU A 90 -4.845 3.833 8.329 1.00 41.53 C ATOM 0 H LEU A 90 -8.922 5.288 8.615 1.00 14.13 H new ATOM 0 HA LEU A 90 -7.064 3.775 10.355 1.00 73.15 H new ATOM 0 HB2 LEU A 90 -6.760 6.541 9.140 1.00 63.52 H new ATOM 0 HB3 LEU A 90 -5.547 5.657 10.044 1.00 63.52 H new ATOM 0 HG LEU A 90 -6.657 4.555 7.466 1.00 50.02 H new ATOM 0 HD11 LEU A 90 -4.773 5.618 6.288 1.00 45.45 H new ATOM 0 HD12 LEU A 90 -5.887 6.824 6.975 1.00 45.45 H new ATOM 0 HD13 LEU A 90 -4.336 6.486 7.779 1.00 45.45 H new ATOM 0 HD21 LEU A 90 -4.464 3.432 7.390 1.00 41.53 H new ATOM 0 HD22 LEU A 90 -4.015 4.214 8.924 1.00 41.53 H new ATOM 0 HD23 LEU A 90 -5.354 3.042 8.881 1.00 41.53 H new ATOM 1371 N LYS A 91 -8.502 4.731 12.225 1.00 44.33 N ATOM 1372 CA LYS A 91 -9.023 5.322 13.451 1.00 0.54 C ATOM 1373 C LYS A 91 -7.890 5.847 14.327 1.00 25.32 C ATOM 1374 O LYS A 91 -6.796 5.280 14.350 1.00 14.13 O ATOM 1375 CB LYS A 91 -9.847 4.293 14.228 1.00 53.13 C ATOM 1376 CG LYS A 91 -11.149 3.915 13.543 1.00 14.10 C ATOM 1377 CD LYS A 91 -11.513 2.462 13.799 1.00 64.03 C ATOM 1378 CE LYS A 91 -12.836 2.095 13.145 1.00 61.11 C ATOM 1379 NZ LYS A 91 -12.835 2.392 11.686 1.00 42.13 N ATOM 0 H LYS A 91 -8.569 3.714 12.186 1.00 44.33 H new ATOM 0 HA LYS A 91 -9.664 6.160 13.176 1.00 0.54 H new ATOM 0 HB2 LYS A 91 -9.248 3.394 14.372 1.00 53.13 H new ATOM 0 HB3 LYS A 91 -10.069 4.691 15.218 1.00 53.13 H new ATOM 0 HG2 LYS A 91 -11.951 4.560 13.902 1.00 14.10 H new ATOM 0 HG3 LYS A 91 -11.059 4.085 12.470 1.00 14.10 H new ATOM 0 HD2 LYS A 91 -10.724 1.815 13.415 1.00 64.03 H new ATOM 0 HD3 LYS A 91 -11.575 2.285 14.873 1.00 64.03 H new ATOM 0 HE2 LYS A 91 -13.036 1.035 13.300 1.00 61.11 H new ATOM 0 HE3 LYS A 91 -13.644 2.645 13.627 1.00 61.11 H new ATOM 0 HZ1 LYS A 91 -13.672 1.962 11.244 1.00 42.13 H new ATOM 0 HZ2 LYS A 91 -12.857 3.422 11.541 1.00 42.13 H new ATOM 0 HZ3 LYS A 91 -11.975 2.000 11.253 1.00 42.13 H new ATOM 1393 N HIS A 92 -8.158 6.931 15.048 1.00 45.11 N ATOM 1394 CA HIS A 92 -7.160 7.530 15.927 1.00 11.24 C ATOM 1395 C HIS A 92 -6.560 6.483 16.861 1.00 42.31 C ATOM 1396 O HIS A 92 -7.184 6.079 17.842 1.00 15.44 O ATOM 1397 CB HIS A 92 -7.784 8.662 16.745 1.00 70.40 C ATOM 1398 CG HIS A 92 -8.744 9.506 15.965 1.00 71.45 C ATOM 1399 ND1 HIS A 92 -10.062 9.155 15.763 1.00 73.25 N ATOM 1400 CD2 HIS A 92 -8.571 10.692 15.336 1.00 35.11 C ATOM 1401 CE1 HIS A 92 -10.658 10.088 15.042 1.00 35.02 C ATOM 1402 NE2 HIS A 92 -9.776 11.032 14.771 1.00 43.24 N ATOM 0 H HIS A 92 -9.057 7.412 15.041 1.00 45.11 H new ATOM 0 HA HIS A 92 -6.362 7.937 15.306 1.00 11.24 H new ATOM 0 HB2 HIS A 92 -8.303 8.235 17.604 1.00 70.40 H new ATOM 0 HB3 HIS A 92 -6.989 9.297 17.136 1.00 70.40 H new ATOM 0 HD2 HIS A 92 -7.656 11.264 15.287 1.00 35.11 H new ATOM 0 HE1 HIS A 92 -11.691 10.080 14.728 1.00 35.02 H new ATOM 0 HE2 HIS A 92 -9.960 11.877 14.230 1.00 43.24 H new ATOM 1410 N THR A 93 -5.344 6.046 16.548 1.00 3.35 N ATOM 1411 CA THR A 93 -4.660 5.045 17.358 1.00 40.35 C ATOM 1412 C THR A 93 -3.292 5.544 17.810 1.00 54.34 C ATOM 1413 O THR A 93 -2.324 4.786 17.844 1.00 34.14 O ATOM 1414 CB THR A 93 -4.482 3.724 16.585 1.00 13.52 C ATOM 1415 OG1 THR A 93 -3.810 3.969 15.345 1.00 52.04 O ATOM 1416 CG2 THR A 93 -5.829 3.069 16.318 1.00 64.33 C ATOM 0 H THR A 93 -4.813 6.369 15.740 1.00 3.35 H new ATOM 0 HA THR A 93 -5.285 4.865 18.233 1.00 40.35 H new ATOM 0 HB THR A 93 -3.882 3.049 17.195 1.00 13.52 H new ATOM 0 HG1 THR A 93 -3.699 3.124 14.861 1.00 52.04 H new ATOM 0 HG21 THR A 93 -5.679 2.138 15.771 1.00 64.33 H new ATOM 0 HG22 THR A 93 -6.325 2.858 17.265 1.00 64.33 H new ATOM 0 HG23 THR A 93 -6.450 3.742 15.726 1.00 64.33 H new ATOM 1424 N GLY A 94 -3.220 6.826 18.156 1.00 21.04 N ATOM 1425 CA GLY A 94 -1.966 7.404 18.603 1.00 62.04 C ATOM 1426 C GLY A 94 -1.821 8.858 18.199 1.00 71.25 C ATOM 1427 O GLY A 94 -2.571 9.371 17.368 1.00 62.14 O ATOM 0 H GLY A 94 -4.007 7.474 18.135 1.00 21.04 H new ATOM 0 HA2 GLY A 94 -1.899 7.323 19.688 1.00 62.04 H new ATOM 0 HA3 GLY A 94 -1.137 6.831 18.188 1.00 62.04 H new ATOM 1431 N PRO A 95 -0.838 9.547 18.796 1.00 64.01 N ATOM 1432 CA PRO A 95 -0.575 10.961 18.510 1.00 61.51 C ATOM 1433 C PRO A 95 -0.007 11.173 17.111 1.00 52.13 C ATOM 1434 O PRO A 95 0.520 10.247 16.497 1.00 60.52 O ATOM 1435 CB PRO A 95 0.457 11.351 19.571 1.00 41.23 C ATOM 1436 CG PRO A 95 1.137 10.074 19.926 1.00 44.33 C ATOM 1437 CD PRO A 95 0.094 8.999 19.796 1.00 1.20 C ATOM 0 HA PRO A 95 -1.485 11.560 18.541 1.00 61.51 H new ATOM 0 HB2 PRO A 95 1.166 12.083 19.183 1.00 41.23 H new ATOM 0 HB3 PRO A 95 -0.021 11.800 20.442 1.00 41.23 H new ATOM 0 HG2 PRO A 95 1.979 9.883 19.261 1.00 44.33 H new ATOM 0 HG3 PRO A 95 1.534 10.112 20.941 1.00 44.33 H new ATOM 0 HD2 PRO A 95 0.528 8.055 19.466 1.00 1.20 H new ATOM 0 HD3 PRO A 95 -0.404 8.805 20.746 1.00 1.20 H new ATOM 1445 N GLY A 96 -0.119 12.401 16.612 1.00 65.32 N ATOM 1446 CA GLY A 96 0.389 12.712 15.288 1.00 13.44 C ATOM 1447 C GLY A 96 -0.633 12.450 14.199 1.00 4.24 C ATOM 1448 O GLY A 96 -0.470 12.901 13.065 1.00 24.41 O ATOM 0 H GLY A 96 -0.552 13.185 17.100 1.00 65.32 H new ATOM 0 HA2 GLY A 96 0.691 13.759 15.255 1.00 13.44 H new ATOM 0 HA3 GLY A 96 1.281 12.117 15.095 1.00 13.44 H new ATOM 1452 N ILE A 97 -1.687 11.719 14.543 1.00 33.24 N ATOM 1453 CA ILE A 97 -2.738 11.397 13.586 1.00 52.20 C ATOM 1454 C ILE A 97 -3.315 12.661 12.957 1.00 3.22 C ATOM 1455 O ILE A 97 -3.599 13.639 13.651 1.00 72.34 O ATOM 1456 CB ILE A 97 -3.878 10.601 14.248 1.00 72.32 C ATOM 1457 CG1 ILE A 97 -3.426 9.169 14.541 1.00 61.33 C ATOM 1458 CG2 ILE A 97 -5.111 10.601 13.357 1.00 72.34 C ATOM 1459 CD1 ILE A 97 -3.135 8.360 13.296 1.00 53.23 C ATOM 0 H ILE A 97 -1.836 11.338 15.477 1.00 33.24 H new ATOM 0 HA ILE A 97 -2.280 10.784 12.810 1.00 52.20 H new ATOM 0 HB ILE A 97 -4.136 11.081 15.192 1.00 72.32 H new ATOM 0 HG12 ILE A 97 -2.531 9.199 15.162 1.00 61.33 H new ATOM 0 HG13 ILE A 97 -4.199 8.664 15.120 1.00 61.33 H new ATOM 0 HG21 ILE A 97 -5.908 10.034 13.839 1.00 72.34 H new ATOM 0 HG22 ILE A 97 -5.442 11.627 13.194 1.00 72.34 H new ATOM 0 HG23 ILE A 97 -4.868 10.142 12.399 1.00 72.34 H new ATOM 0 HD11 ILE A 97 -2.820 7.356 13.580 1.00 53.23 H new ATOM 0 HD12 ILE A 97 -4.035 8.299 12.684 1.00 53.23 H new ATOM 0 HD13 ILE A 97 -2.340 8.842 12.726 1.00 53.23 H new ATOM 1471 N LEU A 98 -3.486 12.635 11.640 1.00 35.42 N ATOM 1472 CA LEU A 98 -4.032 13.778 10.917 1.00 45.05 C ATOM 1473 C LEU A 98 -5.499 13.552 10.568 1.00 53.51 C ATOM 1474 O LEU A 98 -6.010 12.438 10.680 1.00 12.24 O ATOM 1475 CB LEU A 98 -3.226 14.031 9.641 1.00 23.31 C ATOM 1476 CG LEU A 98 -2.322 15.264 9.652 1.00 42.04 C ATOM 1477 CD1 LEU A 98 -1.664 15.455 8.294 1.00 52.43 C ATOM 1478 CD2 LEU A 98 -3.115 16.503 10.042 1.00 65.02 C ATOM 0 H LEU A 98 -3.254 11.835 11.051 1.00 35.42 H new ATOM 0 HA LEU A 98 -3.962 14.653 11.564 1.00 45.05 H new ATOM 0 HB2 LEU A 98 -2.609 13.154 9.445 1.00 23.31 H new ATOM 0 HB3 LEU A 98 -3.922 14.123 8.807 1.00 23.31 H new ATOM 0 HG LEU A 98 -1.538 15.110 10.394 1.00 42.04 H new ATOM 0 HD11 LEU A 98 -1.024 16.337 8.320 1.00 52.43 H new ATOM 0 HD12 LEU A 98 -1.063 14.578 8.054 1.00 52.43 H new ATOM 0 HD13 LEU A 98 -2.433 15.587 7.533 1.00 52.43 H new ATOM 0 HD21 LEU A 98 -2.456 17.371 10.045 1.00 65.02 H new ATOM 0 HD22 LEU A 98 -3.920 16.661 9.324 1.00 65.02 H new ATOM 0 HD23 LEU A 98 -3.538 16.366 11.037 1.00 65.02 H new ATOM 1490 N SER A 99 -6.172 14.617 10.142 1.00 5.24 N ATOM 1491 CA SER A 99 -7.581 14.536 9.778 1.00 32.04 C ATOM 1492 C SER A 99 -8.087 15.879 9.261 1.00 41.05 C ATOM 1493 O SER A 99 -7.340 16.641 8.647 1.00 30.03 O ATOM 1494 CB SER A 99 -8.416 14.094 10.982 1.00 62.30 C ATOM 1495 OG SER A 99 -9.519 13.302 10.575 1.00 45.32 O ATOM 0 H SER A 99 -5.763 15.546 10.041 1.00 5.24 H new ATOM 0 HA SER A 99 -7.683 13.798 8.982 1.00 32.04 H new ATOM 0 HB2 SER A 99 -7.792 13.527 11.673 1.00 62.30 H new ATOM 0 HB3 SER A 99 -8.773 14.971 11.522 1.00 62.30 H new ATOM 0 HG SER A 99 -9.641 12.563 11.206 1.00 45.32 H new ATOM 1501 N MET A 100 -9.361 16.161 9.512 1.00 1.54 N ATOM 1502 CA MET A 100 -9.967 17.413 9.073 1.00 71.11 C ATOM 1503 C MET A 100 -10.995 17.905 10.087 1.00 71.51 C ATOM 1504 O MET A 100 -11.926 17.182 10.441 1.00 22.33 O ATOM 1505 CB MET A 100 -10.629 17.231 7.705 1.00 2.35 C ATOM 1506 CG MET A 100 -9.681 16.714 6.636 1.00 42.34 C ATOM 1507 SD MET A 100 -8.474 17.951 6.121 1.00 63.23 S ATOM 1508 CE MET A 100 -8.296 17.548 4.385 1.00 64.34 C ATOM 0 H MET A 100 -9.994 15.540 10.017 1.00 1.54 H new ATOM 0 HA MET A 100 -9.178 18.161 8.991 1.00 71.11 H new ATOM 0 HB2 MET A 100 -11.465 16.538 7.804 1.00 2.35 H new ATOM 0 HB3 MET A 100 -11.043 18.186 7.381 1.00 2.35 H new ATOM 0 HG2 MET A 100 -9.157 15.836 7.014 1.00 42.34 H new ATOM 0 HG3 MET A 100 -10.258 16.392 5.769 1.00 42.34 H new ATOM 0 HE1 MET A 100 -7.328 17.898 4.028 1.00 64.34 H new ATOM 0 HE2 MET A 100 -8.362 16.468 4.254 1.00 64.34 H new ATOM 0 HE3 MET A 100 -9.090 18.032 3.816 1.00 64.34 H new ATOM 1518 N ALA A 101 -10.820 19.138 10.550 1.00 22.23 N ATOM 1519 CA ALA A 101 -11.733 19.726 11.522 1.00 33.20 C ATOM 1520 C ALA A 101 -12.471 20.922 10.929 1.00 63.52 C ATOM 1521 O ALA A 101 -12.147 22.071 11.224 1.00 31.03 O ATOM 1522 CB ALA A 101 -10.976 20.139 12.775 1.00 31.04 C ATOM 0 H ALA A 101 -10.054 19.749 10.267 1.00 22.23 H new ATOM 0 HA ALA A 101 -12.473 18.972 11.790 1.00 33.20 H new ATOM 0 HB1 ALA A 101 -11.671 20.577 13.492 1.00 31.04 H new ATOM 0 HB2 ALA A 101 -10.501 19.264 13.218 1.00 31.04 H new ATOM 0 HB3 ALA A 101 -10.214 20.873 12.514 1.00 31.04 H new ATOM 1528 N ASN A 102 -13.463 20.642 10.090 1.00 41.21 N ATOM 1529 CA ASN A 102 -14.246 21.696 9.454 1.00 64.31 C ATOM 1530 C ASN A 102 -15.692 21.666 9.937 1.00 34.31 C ATOM 1531 O ASN A 102 -16.298 22.709 10.181 1.00 43.01 O ATOM 1532 CB ASN A 102 -14.201 21.545 7.932 1.00 72.30 C ATOM 1533 CG ASN A 102 -13.264 22.542 7.279 1.00 1.20 C ATOM 1534 OD1 ASN A 102 -13.429 23.753 7.426 1.00 45.42 O ATOM 1535 ND2 ASN A 102 -12.274 22.036 6.553 1.00 50.01 N ATOM 0 H ASN A 102 -13.744 19.695 9.835 1.00 41.21 H new ATOM 0 HA ASN A 102 -13.810 22.656 9.730 1.00 64.31 H new ATOM 0 HB2 ASN A 102 -13.884 20.533 7.679 1.00 72.30 H new ATOM 0 HB3 ASN A 102 -15.205 21.675 7.527 1.00 72.30 H new ATOM 0 HD21 ASN A 102 -11.612 22.658 6.090 1.00 50.01 H new ATOM 0 HD22 ASN A 102 -12.176 21.025 6.459 1.00 50.01 H new ATOM 1542 N ALA A 103 -16.240 20.463 10.074 1.00 70.44 N ATOM 1543 CA ALA A 103 -17.614 20.296 10.530 1.00 12.12 C ATOM 1544 C ALA A 103 -17.927 18.829 10.806 1.00 12.42 C ATOM 1545 O ALA A 103 -19.082 18.409 10.746 1.00 23.11 O ATOM 1546 CB ALA A 103 -18.584 20.860 9.502 1.00 2.22 C ATOM 0 H ALA A 103 -15.753 19.589 9.875 1.00 70.44 H new ATOM 0 HA ALA A 103 -17.730 20.847 11.463 1.00 12.12 H new ATOM 0 HB1 ALA A 103 -19.606 20.728 9.856 1.00 2.22 H new ATOM 0 HB2 ALA A 103 -18.384 21.922 9.357 1.00 2.22 H new ATOM 0 HB3 ALA A 103 -18.457 20.335 8.555 1.00 2.22 H new ATOM 1552 N GLY A 104 -16.890 18.054 11.109 1.00 41.34 N ATOM 1553 CA GLY A 104 -17.076 16.642 11.388 1.00 4.55 C ATOM 1554 C GLY A 104 -17.027 15.792 10.135 1.00 61.31 C ATOM 1555 O GLY A 104 -16.226 16.027 9.230 1.00 24.52 O ATOM 0 H GLY A 104 -15.925 18.379 11.166 1.00 41.34 H new ATOM 0 HA2 GLY A 104 -16.304 16.307 12.081 1.00 4.55 H new ATOM 0 HA3 GLY A 104 -18.035 16.496 11.885 1.00 4.55 H new ATOM 1559 N PRO A 105 -17.900 14.775 10.071 1.00 42.34 N ATOM 1560 CA PRO A 105 -17.972 13.865 8.924 1.00 40.23 C ATOM 1561 C PRO A 105 -18.524 14.547 7.676 1.00 31.05 C ATOM 1562 O PRO A 105 -19.543 14.129 7.129 1.00 72.20 O ATOM 1563 CB PRO A 105 -18.927 12.768 9.401 1.00 53.42 C ATOM 1564 CG PRO A 105 -19.770 13.425 10.439 1.00 2.31 C ATOM 1565 CD PRO A 105 -18.884 14.437 11.112 1.00 21.44 C ATOM 0 HA PRO A 105 -16.988 13.496 8.634 1.00 40.23 H new ATOM 0 HB2 PRO A 105 -19.535 12.388 8.580 1.00 53.42 H new ATOM 0 HB3 PRO A 105 -18.381 11.919 9.813 1.00 53.42 H new ATOM 0 HG2 PRO A 105 -20.639 13.905 9.989 1.00 2.31 H new ATOM 0 HG3 PRO A 105 -20.144 12.695 11.157 1.00 2.31 H new ATOM 0 HD2 PRO A 105 -19.447 15.314 11.433 1.00 21.44 H new ATOM 0 HD3 PRO A 105 -18.404 14.024 11.999 1.00 21.44 H new ATOM 1573 N ASN A 106 -17.844 15.599 7.232 1.00 23.15 N ATOM 1574 CA ASN A 106 -18.267 16.339 6.049 1.00 21.21 C ATOM 1575 C ASN A 106 -17.538 17.675 5.954 1.00 44.44 C ATOM 1576 O ASN A 106 -17.006 18.178 6.944 1.00 2.02 O ATOM 1577 CB ASN A 106 -19.779 16.571 6.081 1.00 41.10 C ATOM 1578 CG ASN A 106 -20.314 16.700 7.494 1.00 53.21 C ATOM 1579 OD1 ASN A 106 -21.286 16.041 7.864 1.00 11.20 O ATOM 1580 ND2 ASN A 106 -19.681 17.553 8.291 1.00 62.11 N ATOM 0 H ASN A 106 -16.998 15.958 7.674 1.00 23.15 H new ATOM 0 HA ASN A 106 -18.016 15.745 5.170 1.00 21.21 H new ATOM 0 HB2 ASN A 106 -20.017 17.476 5.521 1.00 41.10 H new ATOM 0 HB3 ASN A 106 -20.281 15.744 5.579 1.00 41.10 H new ATOM 0 HD21 ASN A 106 -19.996 17.683 9.252 1.00 62.11 H new ATOM 0 HD22 ASN A 106 -18.879 18.078 7.942 1.00 62.11 H new ATOM 1587 N THR A 107 -17.517 18.248 4.754 1.00 61.22 N ATOM 1588 CA THR A 107 -16.853 19.525 4.528 1.00 51.41 C ATOM 1589 C THR A 107 -15.387 19.464 4.940 1.00 63.42 C ATOM 1590 O THR A 107 -14.826 20.447 5.421 1.00 23.24 O ATOM 1591 CB THR A 107 -17.545 20.663 5.303 1.00 62.30 C ATOM 1592 OG1 THR A 107 -17.049 20.713 6.645 1.00 5.32 O ATOM 1593 CG2 THR A 107 -19.053 20.466 5.322 1.00 70.44 C ATOM 0 H THR A 107 -17.953 17.847 3.924 1.00 61.22 H new ATOM 0 HA THR A 107 -16.919 19.730 3.459 1.00 51.41 H new ATOM 0 HB THR A 107 -17.324 21.604 4.798 1.00 62.30 H new ATOM 0 HG1 THR A 107 -17.053 19.811 7.029 1.00 5.32 H new ATOM 0 HG21 THR A 107 -19.520 21.281 5.875 1.00 70.44 H new ATOM 0 HG22 THR A 107 -19.432 20.457 4.300 1.00 70.44 H new ATOM 0 HG23 THR A 107 -19.290 19.518 5.805 1.00 70.44 H new ATOM 1601 N ASN A 108 -14.771 18.302 4.747 1.00 70.44 N ATOM 1602 CA ASN A 108 -13.368 18.112 5.098 1.00 14.04 C ATOM 1603 C ASN A 108 -12.456 18.793 4.082 1.00 30.45 C ATOM 1604 O ASN A 108 -11.697 18.133 3.374 1.00 23.34 O ATOM 1605 CB ASN A 108 -13.038 16.620 5.178 1.00 13.22 C ATOM 1606 CG ASN A 108 -14.207 15.796 5.682 1.00 70.52 C ATOM 1607 OD1 ASN A 108 -14.964 16.235 6.548 1.00 41.14 O ATOM 1608 ND2 ASN A 108 -14.359 14.593 5.140 1.00 20.54 N ATOM 0 H ASN A 108 -15.221 17.478 4.349 1.00 70.44 H new ATOM 0 HA ASN A 108 -13.198 18.567 6.074 1.00 14.04 H new ATOM 0 HB2 ASN A 108 -12.743 16.262 4.191 1.00 13.22 H new ATOM 0 HB3 ASN A 108 -12.183 16.475 5.838 1.00 13.22 H new ATOM 0 HD21 ASN A 108 -15.127 13.992 5.439 1.00 20.54 H new ATOM 0 HD22 ASN A 108 -13.707 14.270 4.425 1.00 20.54 H new ATOM 1615 N GLY A 109 -12.536 20.118 4.018 1.00 53.35 N ATOM 1616 CA GLY A 109 -11.713 20.867 3.086 1.00 24.42 C ATOM 1617 C GLY A 109 -10.231 20.715 3.371 1.00 75.11 C ATOM 1618 O GLY A 109 -9.535 19.965 2.688 1.00 62.44 O ATOM 0 H GLY A 109 -13.156 20.687 4.595 1.00 53.35 H new ATOM 0 HA2 GLY A 109 -11.921 20.531 2.070 1.00 24.42 H new ATOM 0 HA3 GLY A 109 -11.983 21.922 3.134 1.00 24.42 H new ATOM 1622 N SER A 110 -9.748 21.430 4.382 1.00 54.23 N ATOM 1623 CA SER A 110 -8.339 21.376 4.752 1.00 60.13 C ATOM 1624 C SER A 110 -8.119 21.966 6.142 1.00 71.55 C ATOM 1625 O SER A 110 -7.173 22.720 6.364 1.00 42.22 O ATOM 1626 CB SER A 110 -7.491 22.130 3.725 1.00 30.25 C ATOM 1627 OG SER A 110 -6.122 22.120 4.090 1.00 65.05 O ATOM 0 H SER A 110 -10.312 22.054 4.959 1.00 54.23 H new ATOM 0 HA SER A 110 -8.033 20.330 4.768 1.00 60.13 H new ATOM 0 HB2 SER A 110 -7.612 21.673 2.743 1.00 30.25 H new ATOM 0 HB3 SER A 110 -7.842 23.159 3.644 1.00 30.25 H new ATOM 0 HG SER A 110 -6.026 22.444 5.010 1.00 65.05 H new ATOM 1633 N GLN A 111 -9.001 21.615 7.072 1.00 24.24 N ATOM 1634 CA GLN A 111 -8.904 22.110 8.441 1.00 63.34 C ATOM 1635 C GLN A 111 -8.303 21.052 9.361 1.00 74.12 C ATOM 1636 O GLN A 111 -8.736 20.890 10.502 1.00 23.41 O ATOM 1637 CB GLN A 111 -10.283 22.526 8.954 1.00 73.42 C ATOM 1638 CG GLN A 111 -10.728 23.894 8.464 1.00 44.25 C ATOM 1639 CD GLN A 111 -9.763 24.996 8.856 1.00 51.11 C ATOM 1640 OE1 GLN A 111 -9.770 25.467 9.993 1.00 14.44 O ATOM 1641 NE2 GLN A 111 -8.926 25.413 7.914 1.00 45.23 N ATOM 0 H GLN A 111 -9.790 20.991 6.903 1.00 24.24 H new ATOM 0 HA GLN A 111 -8.247 22.980 8.441 1.00 63.34 H new ATOM 0 HB2 GLN A 111 -11.016 21.782 8.643 1.00 73.42 H new ATOM 0 HB3 GLN A 111 -10.271 22.526 10.044 1.00 73.42 H new ATOM 0 HG2 GLN A 111 -10.828 23.872 7.379 1.00 44.25 H new ATOM 0 HG3 GLN A 111 -11.714 24.118 8.870 1.00 44.25 H new ATOM 0 HE21 GLN A 111 -8.955 24.994 6.984 1.00 45.23 H new ATOM 0 HE22 GLN A 111 -8.254 26.152 8.120 1.00 45.23 H new ATOM 1650 N PHE A 112 -7.305 20.334 8.857 1.00 51.02 N ATOM 1651 CA PHE A 112 -6.646 19.290 9.633 1.00 10.32 C ATOM 1652 C PHE A 112 -6.121 19.845 10.954 1.00 24.22 C ATOM 1653 O PHE A 112 -6.302 21.023 11.262 1.00 42.13 O ATOM 1654 CB PHE A 112 -5.496 18.678 8.831 1.00 32.50 C ATOM 1655 CG PHE A 112 -4.306 19.584 8.701 1.00 2.32 C ATOM 1656 CD1 PHE A 112 -3.327 19.610 9.682 1.00 74.42 C ATOM 1657 CD2 PHE A 112 -4.166 20.412 7.599 1.00 63.33 C ATOM 1658 CE1 PHE A 112 -2.230 20.443 9.565 1.00 35.43 C ATOM 1659 CE2 PHE A 112 -3.071 21.246 7.477 1.00 41.45 C ATOM 1660 CZ PHE A 112 -2.103 21.263 8.462 1.00 62.24 C ATOM 0 H PHE A 112 -6.935 20.456 7.914 1.00 51.02 H new ATOM 0 HA PHE A 112 -7.381 18.515 9.851 1.00 10.32 H new ATOM 0 HB2 PHE A 112 -5.185 17.749 9.309 1.00 32.50 H new ATOM 0 HB3 PHE A 112 -5.856 18.419 7.835 1.00 32.50 H new ATOM 0 HD1 PHE A 112 -3.422 18.972 10.548 1.00 74.42 H new ATOM 0 HD2 PHE A 112 -4.921 20.406 6.827 1.00 63.33 H new ATOM 0 HE1 PHE A 112 -1.473 20.452 10.336 1.00 35.43 H new ATOM 0 HE2 PHE A 112 -2.972 21.884 6.612 1.00 41.45 H new ATOM 0 HZ PHE A 112 -1.248 21.917 8.369 1.00 62.24 H new ATOM 1670 N PHE A 113 -5.469 18.986 11.732 1.00 53.40 N ATOM 1671 CA PHE A 113 -4.919 19.389 13.021 1.00 65.31 C ATOM 1672 C PHE A 113 -3.793 18.451 13.448 1.00 71.10 C ATOM 1673 O PHE A 113 -3.407 17.549 12.704 1.00 4.00 O ATOM 1674 CB PHE A 113 -6.017 19.404 14.086 1.00 3.22 C ATOM 1675 CG PHE A 113 -6.945 18.226 14.007 1.00 11.23 C ATOM 1676 CD1 PHE A 113 -6.504 17.012 13.506 1.00 54.35 C ATOM 1677 CD2 PHE A 113 -8.259 18.333 14.434 1.00 0.13 C ATOM 1678 CE1 PHE A 113 -7.356 15.926 13.432 1.00 51.12 C ATOM 1679 CE2 PHE A 113 -9.115 17.250 14.363 1.00 10.44 C ATOM 1680 CZ PHE A 113 -8.663 16.046 13.860 1.00 35.14 C ATOM 0 H PHE A 113 -5.309 18.008 11.492 1.00 53.40 H new ATOM 0 HA PHE A 113 -4.511 20.394 12.916 1.00 65.31 H new ATOM 0 HB2 PHE A 113 -5.555 19.426 15.073 1.00 3.22 H new ATOM 0 HB3 PHE A 113 -6.597 20.321 13.985 1.00 3.22 H new ATOM 0 HD1 PHE A 113 -5.483 16.913 13.169 1.00 54.35 H new ATOM 0 HD2 PHE A 113 -8.618 19.273 14.827 1.00 0.13 H new ATOM 0 HE1 PHE A 113 -7.000 14.985 13.040 1.00 51.12 H new ATOM 0 HE2 PHE A 113 -10.136 17.345 14.701 1.00 10.44 H new ATOM 0 HZ PHE A 113 -9.331 15.199 13.802 1.00 35.14 H new ATOM 1690 N ILE A 114 -3.272 18.671 14.650 1.00 3.31 N ATOM 1691 CA ILE A 114 -2.192 17.846 15.177 1.00 45.44 C ATOM 1692 C ILE A 114 -2.593 17.190 16.493 1.00 21.21 C ATOM 1693 O ILE A 114 -2.438 17.778 17.564 1.00 31.33 O ATOM 1694 CB ILE A 114 -0.910 18.671 15.397 1.00 24.10 C ATOM 1695 CG1 ILE A 114 -0.242 18.985 14.056 1.00 14.14 C ATOM 1696 CG2 ILE A 114 0.050 17.923 16.310 1.00 5.54 C ATOM 1697 CD1 ILE A 114 0.009 20.461 13.838 1.00 72.44 C ATOM 0 H ILE A 114 -3.580 19.414 15.278 1.00 3.31 H new ATOM 0 HA ILE A 114 -1.994 17.073 14.434 1.00 45.44 H new ATOM 0 HB ILE A 114 -1.179 19.612 15.876 1.00 24.10 H new ATOM 0 HG12 ILE A 114 0.706 18.451 13.998 1.00 14.14 H new ATOM 0 HG13 ILE A 114 -0.870 18.608 13.249 1.00 14.14 H new ATOM 0 HG21 ILE A 114 0.951 18.518 16.456 1.00 5.54 H new ATOM 0 HG22 ILE A 114 -0.428 17.745 17.273 1.00 5.54 H new ATOM 0 HG23 ILE A 114 0.315 16.969 15.855 1.00 5.54 H new ATOM 0 HD11 ILE A 114 0.484 20.610 12.868 1.00 72.44 H new ATOM 0 HD12 ILE A 114 -0.939 20.999 13.864 1.00 72.44 H new ATOM 0 HD13 ILE A 114 0.663 20.839 14.624 1.00 72.44 H new ATOM 1709 N CYS A 115 -3.107 15.968 16.406 1.00 50.12 N ATOM 1710 CA CYS A 115 -3.530 15.230 17.591 1.00 41.13 C ATOM 1711 C CYS A 115 -2.326 14.807 18.426 1.00 11.33 C ATOM 1712 O CYS A 115 -1.794 13.709 18.259 1.00 53.24 O ATOM 1713 CB CYS A 115 -4.343 14.000 17.187 1.00 35.52 C ATOM 1714 SG CYS A 115 -5.726 14.360 16.079 1.00 61.51 S ATOM 0 H CYS A 115 -3.241 15.467 15.527 1.00 50.12 H new ATOM 0 HA CYS A 115 -4.155 15.888 18.195 1.00 41.13 H new ATOM 0 HB2 CYS A 115 -3.680 13.283 16.702 1.00 35.52 H new ATOM 0 HB3 CYS A 115 -4.728 13.521 18.087 1.00 35.52 H new ATOM 0 HG CYS A 115 -5.341 14.222 14.845 1.00 61.51 H new ATOM 1720 N THR A 116 -1.899 15.687 19.327 1.00 62.01 N ATOM 1721 CA THR A 116 -0.756 15.407 20.187 1.00 71.31 C ATOM 1722 C THR A 116 -1.012 14.183 21.060 1.00 43.52 C ATOM 1723 O THR A 116 -0.086 13.625 21.648 1.00 35.30 O ATOM 1724 CB THR A 116 -0.426 16.609 21.091 1.00 25.15 C ATOM 1725 OG1 THR A 116 -1.605 17.047 21.774 1.00 14.14 O ATOM 1726 CG2 THR A 116 0.151 17.757 20.277 1.00 70.13 C ATOM 0 H THR A 116 -2.328 16.600 19.480 1.00 62.01 H new ATOM 0 HA THR A 116 0.093 15.211 19.532 1.00 71.31 H new ATOM 0 HB THR A 116 0.319 16.292 21.821 1.00 25.15 H new ATOM 0 HG1 THR A 116 -1.386 17.811 22.348 1.00 14.14 H new ATOM 0 HG21 THR A 116 0.376 18.594 20.938 1.00 70.13 H new ATOM 0 HG22 THR A 116 1.065 17.429 19.783 1.00 70.13 H new ATOM 0 HG23 THR A 116 -0.574 18.072 19.527 1.00 70.13 H new ATOM 1734 N ALA A 117 -2.273 13.772 21.139 1.00 21.00 N ATOM 1735 CA ALA A 117 -2.649 12.613 21.938 1.00 35.33 C ATOM 1736 C ALA A 117 -3.758 11.815 21.260 1.00 20.10 C ATOM 1737 O ALA A 117 -4.548 12.361 20.489 1.00 23.41 O ATOM 1738 CB ALA A 117 -3.086 13.050 23.329 1.00 70.42 C ATOM 0 H ALA A 117 -3.051 14.224 20.659 1.00 21.00 H new ATOM 0 HA ALA A 117 -1.776 11.967 22.029 1.00 35.33 H new ATOM 0 HB1 ALA A 117 -3.364 12.174 23.915 1.00 70.42 H new ATOM 0 HB2 ALA A 117 -2.265 13.570 23.822 1.00 70.42 H new ATOM 0 HB3 ALA A 117 -3.943 13.719 23.248 1.00 70.42 H new ATOM 1744 N LYS A 118 -3.811 10.520 21.551 1.00 32.51 N ATOM 1745 CA LYS A 118 -4.823 9.645 20.970 1.00 13.32 C ATOM 1746 C LYS A 118 -6.225 10.190 21.227 1.00 21.42 C ATOM 1747 O LYS A 118 -6.825 9.923 22.269 1.00 3.12 O ATOM 1748 CB LYS A 118 -4.699 8.233 21.547 1.00 12.43 C ATOM 1749 CG LYS A 118 -5.955 7.395 21.380 1.00 42.23 C ATOM 1750 CD LYS A 118 -5.645 5.909 21.440 1.00 32.21 C ATOM 1751 CE LYS A 118 -6.823 5.074 20.959 1.00 5.44 C ATOM 1752 NZ LYS A 118 -6.420 3.675 20.647 1.00 2.11 N ATOM 0 H LYS A 118 -3.164 10.052 22.186 1.00 32.51 H new ATOM 0 HA LYS A 118 -4.659 9.606 19.893 1.00 13.32 H new ATOM 0 HB2 LYS A 118 -3.866 7.724 21.063 1.00 12.43 H new ATOM 0 HB3 LYS A 118 -4.457 8.303 22.608 1.00 12.43 H new ATOM 0 HG2 LYS A 118 -6.671 7.650 22.162 1.00 42.23 H new ATOM 0 HG3 LYS A 118 -6.427 7.631 20.426 1.00 42.23 H new ATOM 0 HD2 LYS A 118 -4.770 5.694 20.826 1.00 32.21 H new ATOM 0 HD3 LYS A 118 -5.393 5.630 22.463 1.00 32.21 H new ATOM 0 HE2 LYS A 118 -7.599 5.066 21.724 1.00 5.44 H new ATOM 0 HE3 LYS A 118 -7.256 5.534 20.071 1.00 5.44 H new ATOM 0 HZ1 LYS A 118 -7.209 3.182 20.181 1.00 2.11 H new ATOM 0 HZ2 LYS A 118 -5.595 3.684 20.014 1.00 2.11 H new ATOM 0 HZ3 LYS A 118 -6.175 3.180 21.528 1.00 2.11 H new ATOM 1766 N THR A 119 -6.743 10.953 20.270 1.00 33.10 N ATOM 1767 CA THR A 119 -8.074 11.534 20.393 1.00 51.13 C ATOM 1768 C THR A 119 -9.125 10.644 19.740 1.00 72.22 C ATOM 1769 O THR A 119 -9.906 11.100 18.905 1.00 0.24 O ATOM 1770 CB THR A 119 -8.136 12.935 19.755 1.00 34.20 C ATOM 1771 OG1 THR A 119 -8.084 12.826 18.328 1.00 4.32 O ATOM 1772 CG2 THR A 119 -6.988 13.804 20.245 1.00 13.24 C ATOM 0 H THR A 119 -6.261 11.183 19.401 1.00 33.10 H new ATOM 0 HA THR A 119 -8.285 11.618 21.459 1.00 51.13 H new ATOM 0 HB THR A 119 -9.076 13.403 20.049 1.00 34.20 H new ATOM 0 HG1 THR A 119 -7.333 13.355 17.987 1.00 4.32 H new ATOM 0 HG21 THR A 119 -7.053 14.788 19.781 1.00 13.24 H new ATOM 0 HG22 THR A 119 -7.048 13.909 21.328 1.00 13.24 H new ATOM 0 HG23 THR A 119 -6.039 13.339 19.977 1.00 13.24 H new ATOM 1780 N GLU A 120 -9.139 9.372 20.126 1.00 73.32 N ATOM 1781 CA GLU A 120 -10.096 8.418 19.576 1.00 22.05 C ATOM 1782 C GLU A 120 -11.517 8.760 20.014 1.00 32.41 C ATOM 1783 O GLU A 120 -12.487 8.394 19.350 1.00 70.10 O ATOM 1784 CB GLU A 120 -9.742 6.996 20.017 1.00 15.15 C ATOM 1785 CG GLU A 120 -9.770 6.801 21.524 1.00 13.52 C ATOM 1786 CD GLU A 120 -10.602 5.605 21.943 1.00 71.34 C ATOM 1787 OE1 GLU A 120 -11.696 5.415 21.371 1.00 32.50 O ATOM 1788 OE2 GLU A 120 -10.160 4.859 22.841 1.00 62.10 O ATOM 0 H GLU A 120 -8.500 8.978 20.816 1.00 73.32 H new ATOM 0 HA GLU A 120 -10.046 8.476 18.489 1.00 22.05 H new ATOM 0 HB2 GLU A 120 -10.440 6.297 19.556 1.00 15.15 H new ATOM 0 HB3 GLU A 120 -8.748 6.746 19.645 1.00 15.15 H new ATOM 0 HG2 GLU A 120 -8.751 6.675 21.889 1.00 13.52 H new ATOM 0 HG3 GLU A 120 -10.169 7.699 21.995 1.00 13.52 H new ATOM 1795 N TRP A 121 -11.632 9.462 21.135 1.00 24.24 N ATOM 1796 CA TRP A 121 -12.934 9.853 21.663 1.00 72.42 C ATOM 1797 C TRP A 121 -13.795 10.484 20.574 1.00 0.13 C ATOM 1798 O TRP A 121 -15.023 10.389 20.606 1.00 24.33 O ATOM 1799 CB TRP A 121 -12.764 10.830 22.827 1.00 43.12 C ATOM 1800 CG TRP A 121 -11.820 11.955 22.525 1.00 72.24 C ATOM 1801 CD1 TRP A 121 -12.052 13.021 21.704 1.00 55.32 C ATOM 1802 CD2 TRP A 121 -10.494 12.123 23.038 1.00 35.35 C ATOM 1803 NE1 TRP A 121 -10.951 13.842 21.676 1.00 1.25 N ATOM 1804 CE2 TRP A 121 -9.982 13.314 22.488 1.00 61.44 C ATOM 1805 CE3 TRP A 121 -9.691 11.384 23.912 1.00 53.42 C ATOM 1806 CZ2 TRP A 121 -8.703 13.779 22.782 1.00 52.42 C ATOM 1807 CZ3 TRP A 121 -8.422 11.848 24.203 1.00 54.05 C ATOM 1808 CH2 TRP A 121 -7.939 13.037 23.640 1.00 64.42 C ATOM 0 H TRP A 121 -10.839 9.772 21.696 1.00 24.24 H new ATOM 0 HA TRP A 121 -13.437 8.955 22.023 1.00 72.42 H new ATOM 0 HB2 TRP A 121 -13.738 11.243 23.091 1.00 43.12 H new ATOM 0 HB3 TRP A 121 -12.402 10.286 23.699 1.00 43.12 H new ATOM 0 HD1 TRP A 121 -12.967 13.193 21.157 1.00 55.32 H new ATOM 0 HE1 TRP A 121 -10.868 14.705 21.138 1.00 1.25 H new ATOM 0 HE3 TRP A 121 -10.056 10.467 24.352 1.00 53.42 H new ATOM 0 HZ2 TRP A 121 -8.327 14.694 22.348 1.00 52.42 H new ATOM 0 HZ3 TRP A 121 -7.792 11.285 24.876 1.00 54.05 H new ATOM 0 HH2 TRP A 121 -6.944 13.374 23.889 1.00 64.42 H new ATOM 1819 N LEU A 122 -13.145 11.129 19.612 1.00 60.33 N ATOM 1820 CA LEU A 122 -13.852 11.776 18.512 1.00 1.20 C ATOM 1821 C LEU A 122 -14.906 10.846 17.920 1.00 51.31 C ATOM 1822 O LEU A 122 -15.962 11.294 17.472 1.00 21.10 O ATOM 1823 CB LEU A 122 -12.864 12.203 17.425 1.00 24.03 C ATOM 1824 CG LEU A 122 -11.828 13.251 17.834 1.00 0.11 C ATOM 1825 CD1 LEU A 122 -10.610 13.180 16.927 1.00 43.15 C ATOM 1826 CD2 LEU A 122 -12.438 14.645 17.802 1.00 34.34 C ATOM 0 H LEU A 122 -12.130 11.218 19.571 1.00 60.33 H new ATOM 0 HA LEU A 122 -14.354 12.660 18.906 1.00 1.20 H new ATOM 0 HB2 LEU A 122 -12.336 11.317 17.074 1.00 24.03 H new ATOM 0 HB3 LEU A 122 -13.431 12.592 16.579 1.00 24.03 H new ATOM 0 HG LEU A 122 -11.509 13.039 18.854 1.00 0.11 H new ATOM 0 HD11 LEU A 122 -9.884 13.933 17.233 1.00 43.15 H new ATOM 0 HD12 LEU A 122 -10.159 12.190 17.000 1.00 43.15 H new ATOM 0 HD13 LEU A 122 -10.912 13.366 15.896 1.00 43.15 H new ATOM 0 HD21 LEU A 122 -11.687 15.378 18.096 1.00 34.34 H new ATOM 0 HD22 LEU A 122 -12.786 14.867 16.793 1.00 34.34 H new ATOM 0 HD23 LEU A 122 -13.279 14.690 18.494 1.00 34.34 H new ATOM 1838 N ASP A 123 -14.613 9.551 17.923 1.00 72.40 N ATOM 1839 CA ASP A 123 -15.537 8.557 17.389 1.00 32.41 C ATOM 1840 C ASP A 123 -15.866 8.849 15.928 1.00 4.24 C ATOM 1841 O ASP A 123 -16.912 9.418 15.619 1.00 64.13 O ATOM 1842 CB ASP A 123 -16.822 8.527 18.218 1.00 74.23 C ATOM 1843 CG ASP A 123 -16.798 7.451 19.286 1.00 71.15 C ATOM 1844 OD1 ASP A 123 -16.319 6.336 18.993 1.00 60.34 O ATOM 1845 OD2 ASP A 123 -17.259 7.724 20.414 1.00 61.21 O ATOM 0 H ASP A 123 -13.743 9.164 18.289 1.00 72.40 H new ATOM 0 HA ASP A 123 -15.054 7.581 17.445 1.00 32.41 H new ATOM 0 HB2 ASP A 123 -16.970 9.499 18.689 1.00 74.23 H new ATOM 0 HB3 ASP A 123 -17.673 8.360 17.558 1.00 74.23 H new ATOM 1850 N GLY A 124 -14.963 8.457 15.034 1.00 73.11 N ATOM 1851 CA GLY A 124 -15.175 8.687 13.617 1.00 70.22 C ATOM 1852 C GLY A 124 -15.870 10.005 13.341 1.00 41.42 C ATOM 1853 O GLY A 124 -16.781 10.075 12.516 1.00 53.31 O ATOM 0 H GLY A 124 -14.089 7.985 15.266 1.00 73.11 H new ATOM 0 HA2 GLY A 124 -14.214 8.672 13.102 1.00 70.22 H new ATOM 0 HA3 GLY A 124 -15.771 7.872 13.205 1.00 70.22 H new ATOM 1857 N LYS A 125 -15.441 11.055 14.034 1.00 62.14 N ATOM 1858 CA LYS A 125 -16.027 12.378 13.860 1.00 13.53 C ATOM 1859 C LYS A 125 -15.435 13.081 12.643 1.00 5.22 C ATOM 1860 O LYS A 125 -15.990 14.063 12.149 1.00 71.33 O ATOM 1861 CB LYS A 125 -15.801 13.227 15.113 1.00 4.43 C ATOM 1862 CG LYS A 125 -17.087 13.703 15.767 1.00 43.15 C ATOM 1863 CD LYS A 125 -17.979 14.432 14.776 1.00 61.12 C ATOM 1864 CE LYS A 125 -19.264 13.662 14.512 1.00 0.10 C ATOM 1865 NZ LYS A 125 -20.122 13.583 15.726 1.00 14.13 N ATOM 0 H LYS A 125 -14.689 11.015 14.722 1.00 62.14 H new ATOM 0 HA LYS A 125 -17.098 12.255 13.700 1.00 13.53 H new ATOM 0 HB2 LYS A 125 -15.229 12.646 15.837 1.00 4.43 H new ATOM 0 HB3 LYS A 125 -15.195 14.094 14.850 1.00 4.43 H new ATOM 0 HG2 LYS A 125 -17.623 12.849 16.181 1.00 43.15 H new ATOM 0 HG3 LYS A 125 -16.850 14.365 16.600 1.00 43.15 H new ATOM 0 HD2 LYS A 125 -18.220 15.423 15.162 1.00 61.12 H new ATOM 0 HD3 LYS A 125 -17.441 14.577 13.839 1.00 61.12 H new ATOM 0 HE2 LYS A 125 -19.818 14.145 13.707 1.00 0.10 H new ATOM 0 HE3 LYS A 125 -19.021 12.655 14.173 1.00 0.10 H new ATOM 0 HZ1 LYS A 125 -21.106 13.400 15.444 1.00 14.13 H new ATOM 0 HZ2 LYS A 125 -19.788 12.811 16.338 1.00 14.13 H new ATOM 0 HZ3 LYS A 125 -20.072 14.483 16.246 1.00 14.13 H new ATOM 1879 N HIS A 126 -14.304 12.572 12.164 1.00 71.03 N ATOM 1880 CA HIS A 126 -13.637 13.150 11.002 1.00 12.15 C ATOM 1881 C HIS A 126 -13.022 12.060 10.130 1.00 30.35 C ATOM 1882 O HIS A 126 -13.306 10.875 10.308 1.00 64.11 O ATOM 1883 CB HIS A 126 -12.555 14.135 11.447 1.00 73.20 C ATOM 1884 CG HIS A 126 -12.943 14.953 12.640 1.00 35.42 C ATOM 1885 ND1 HIS A 126 -13.912 15.934 12.598 1.00 65.35 N ATOM 1886 CD2 HIS A 126 -12.489 14.930 13.915 1.00 31.40 C ATOM 1887 CE1 HIS A 126 -14.035 16.480 13.794 1.00 24.00 C ATOM 1888 NE2 HIS A 126 -13.183 15.888 14.612 1.00 41.21 N ATOM 0 H HIS A 126 -13.830 11.761 12.562 1.00 71.03 H new ATOM 0 HA HIS A 126 -14.383 13.683 10.413 1.00 12.15 H new ATOM 0 HB2 HIS A 126 -11.644 13.582 11.677 1.00 73.20 H new ATOM 0 HB3 HIS A 126 -12.321 14.804 10.619 1.00 73.20 H new ATOM 0 HD1 HIS A 126 -14.450 16.197 11.772 1.00 65.35 H new ATOM 0 HD2 HIS A 126 -11.723 14.279 14.310 1.00 31.40 H new ATOM 0 HE1 HIS A 126 -14.716 17.275 14.059 1.00 24.00 H new ATOM 1896 N VAL A 127 -12.179 12.468 9.187 1.00 1.14 N ATOM 1897 CA VAL A 127 -11.523 11.526 8.288 1.00 55.31 C ATOM 1898 C VAL A 127 -10.006 11.612 8.413 1.00 35.21 C ATOM 1899 O VAL A 127 -9.403 12.635 8.090 1.00 63.20 O ATOM 1900 CB VAL A 127 -11.922 11.780 6.822 1.00 42.31 C ATOM 1901 CG1 VAL A 127 -11.047 10.965 5.882 1.00 44.52 C ATOM 1902 CG2 VAL A 127 -13.393 11.459 6.607 1.00 50.03 C ATOM 0 H VAL A 127 -11.934 13.445 9.026 1.00 1.14 H new ATOM 0 HA VAL A 127 -11.852 10.528 8.579 1.00 55.31 H new ATOM 0 HB VAL A 127 -11.768 12.836 6.599 1.00 42.31 H new ATOM 0 HG11 VAL A 127 -11.343 11.157 4.851 1.00 44.52 H new ATOM 0 HG12 VAL A 127 -10.003 11.249 6.019 1.00 44.52 H new ATOM 0 HG13 VAL A 127 -11.166 9.904 6.102 1.00 44.52 H new ATOM 0 HG21 VAL A 127 -13.657 11.644 5.566 1.00 50.03 H new ATOM 0 HG22 VAL A 127 -13.576 10.412 6.847 1.00 50.03 H new ATOM 0 HG23 VAL A 127 -14.002 12.091 7.254 1.00 50.03 H new ATOM 1912 N VAL A 128 -9.395 10.529 8.884 1.00 11.41 N ATOM 1913 CA VAL A 128 -7.947 10.481 9.051 1.00 74.23 C ATOM 1914 C VAL A 128 -7.261 10.036 7.764 1.00 22.14 C ATOM 1915 O VAL A 128 -7.677 9.067 7.129 1.00 24.42 O ATOM 1916 CB VAL A 128 -7.545 9.526 10.191 1.00 55.42 C ATOM 1917 CG1 VAL A 128 -6.063 9.194 10.112 1.00 52.40 C ATOM 1918 CG2 VAL A 128 -7.893 10.134 11.541 1.00 10.24 C ATOM 0 H VAL A 128 -9.880 9.674 9.156 1.00 11.41 H new ATOM 0 HA VAL A 128 -7.623 11.491 9.302 1.00 74.23 H new ATOM 0 HB VAL A 128 -8.106 8.598 10.080 1.00 55.42 H new ATOM 0 HG11 VAL A 128 -5.798 8.518 10.925 1.00 52.40 H new ATOM 0 HG12 VAL A 128 -5.848 8.714 9.157 1.00 52.40 H new ATOM 0 HG13 VAL A 128 -5.480 10.111 10.197 1.00 52.40 H new ATOM 0 HG21 VAL A 128 -7.602 9.447 12.335 1.00 10.24 H new ATOM 0 HG22 VAL A 128 -7.360 11.077 11.664 1.00 10.24 H new ATOM 0 HG23 VAL A 128 -8.967 10.315 11.593 1.00 10.24 H new ATOM 1928 N PHE A 129 -6.206 10.750 7.385 1.00 13.34 N ATOM 1929 CA PHE A 129 -5.461 10.430 6.174 1.00 71.43 C ATOM 1930 C PHE A 129 -4.024 10.933 6.270 1.00 41.43 C ATOM 1931 O PHE A 129 -3.476 11.466 5.306 1.00 44.21 O ATOM 1932 CB PHE A 129 -6.147 11.041 4.951 1.00 52.44 C ATOM 1933 CG PHE A 129 -6.076 12.541 4.911 1.00 42.22 C ATOM 1934 CD1 PHE A 129 -6.843 13.308 5.773 1.00 74.42 C ATOM 1935 CD2 PHE A 129 -5.241 13.185 4.011 1.00 74.51 C ATOM 1936 CE1 PHE A 129 -6.780 14.688 5.739 1.00 22.01 C ATOM 1937 CE2 PHE A 129 -5.173 14.564 3.973 1.00 54.41 C ATOM 1938 CZ PHE A 129 -5.944 15.317 4.837 1.00 14.12 C ATOM 0 H PHE A 129 -5.848 11.554 7.900 1.00 13.34 H new ATOM 0 HA PHE A 129 -5.441 9.346 6.066 1.00 71.43 H new ATOM 0 HB2 PHE A 129 -5.687 10.639 4.048 1.00 52.44 H new ATOM 0 HB3 PHE A 129 -7.193 10.734 4.940 1.00 52.44 H new ATOM 0 HD1 PHE A 129 -7.498 12.821 6.480 1.00 74.42 H new ATOM 0 HD2 PHE A 129 -4.637 12.602 3.332 1.00 74.51 H new ATOM 0 HE1 PHE A 129 -7.383 15.274 6.417 1.00 22.01 H new ATOM 0 HE2 PHE A 129 -4.517 15.053 3.268 1.00 54.41 H new ATOM 0 HZ PHE A 129 -5.893 16.395 4.807 1.00 14.12 H new ATOM 1948 N GLY A 130 -3.419 10.761 7.441 1.00 35.34 N ATOM 1949 CA GLY A 130 -2.052 11.203 7.643 1.00 12.42 C ATOM 1950 C GLY A 130 -1.555 10.928 9.048 1.00 11.35 C ATOM 1951 O GLY A 130 -2.307 10.452 9.899 1.00 0.24 O ATOM 0 H GLY A 130 -3.852 10.323 8.254 1.00 35.34 H new ATOM 0 HA2 GLY A 130 -1.402 10.701 6.926 1.00 12.42 H new ATOM 0 HA3 GLY A 130 -1.985 12.272 7.440 1.00 12.42 H new ATOM 1955 N LYS A 131 -0.284 11.227 9.294 1.00 62.23 N ATOM 1956 CA LYS A 131 0.315 11.009 10.605 1.00 35.03 C ATOM 1957 C LYS A 131 1.742 11.544 10.648 1.00 42.32 C ATOM 1958 O LYS A 131 2.482 11.447 9.668 1.00 14.32 O ATOM 1959 CB LYS A 131 0.307 9.518 10.951 1.00 40.11 C ATOM 1960 CG LYS A 131 1.183 8.678 10.038 1.00 24.12 C ATOM 1961 CD LYS A 131 1.579 7.367 10.697 1.00 73.11 C ATOM 1962 CE LYS A 131 3.000 6.966 10.332 1.00 11.11 C ATOM 1963 NZ LYS A 131 3.670 6.229 11.439 1.00 10.32 N ATOM 0 H LYS A 131 0.352 11.622 8.601 1.00 62.23 H new ATOM 0 HA LYS A 131 -0.279 11.550 11.342 1.00 35.03 H new ATOM 0 HB2 LYS A 131 0.642 9.391 11.980 1.00 40.11 H new ATOM 0 HB3 LYS A 131 -0.717 9.147 10.901 1.00 40.11 H new ATOM 0 HG2 LYS A 131 0.651 8.473 9.109 1.00 24.12 H new ATOM 0 HG3 LYS A 131 2.079 9.239 9.775 1.00 24.12 H new ATOM 0 HD2 LYS A 131 1.494 7.462 11.779 1.00 73.11 H new ATOM 0 HD3 LYS A 131 0.888 6.581 10.391 1.00 73.11 H new ATOM 0 HE2 LYS A 131 2.983 6.342 9.438 1.00 11.11 H new ATOM 0 HE3 LYS A 131 3.577 7.858 10.087 1.00 11.11 H new ATOM 0 HZ1 LYS A 131 4.636 5.973 11.151 1.00 10.32 H new ATOM 0 HZ2 LYS A 131 3.709 6.833 12.285 1.00 10.32 H new ATOM 0 HZ3 LYS A 131 3.133 5.365 11.656 1.00 10.32 H new ATOM 1977 N VAL A 132 2.124 12.108 11.789 1.00 4.23 N ATOM 1978 CA VAL A 132 3.465 12.656 11.960 1.00 14.40 C ATOM 1979 C VAL A 132 4.523 11.695 11.430 1.00 0.45 C ATOM 1980 O VAL A 132 4.728 10.614 11.982 1.00 31.03 O ATOM 1981 CB VAL A 132 3.761 12.964 13.440 1.00 53.11 C ATOM 1982 CG1 VAL A 132 5.251 13.184 13.652 1.00 72.01 C ATOM 1983 CG2 VAL A 132 2.964 14.175 13.902 1.00 73.23 C ATOM 0 H VAL A 132 1.524 12.198 12.609 1.00 4.23 H new ATOM 0 HA VAL A 132 3.503 13.584 11.389 1.00 14.40 H new ATOM 0 HB VAL A 132 3.456 12.106 14.040 1.00 53.11 H new ATOM 0 HG11 VAL A 132 5.441 13.400 14.703 1.00 72.01 H new ATOM 0 HG12 VAL A 132 5.796 12.286 13.362 1.00 72.01 H new ATOM 0 HG13 VAL A 132 5.585 14.024 13.043 1.00 72.01 H new ATOM 0 HG21 VAL A 132 3.185 14.378 14.950 1.00 73.23 H new ATOM 0 HG22 VAL A 132 3.236 15.041 13.299 1.00 73.23 H new ATOM 0 HG23 VAL A 132 1.899 13.974 13.789 1.00 73.23 H new ATOM 1993 N LYS A 133 5.194 12.097 10.356 1.00 24.15 N ATOM 1994 CA LYS A 133 6.234 11.273 9.751 1.00 3.14 C ATOM 1995 C LYS A 133 7.508 11.302 10.590 1.00 42.52 C ATOM 1996 O LYS A 133 7.961 10.270 11.082 1.00 22.22 O ATOM 1997 CB LYS A 133 6.535 11.757 8.331 1.00 73.21 C ATOM 1998 CG LYS A 133 6.503 10.649 7.292 1.00 40.31 C ATOM 1999 CD LYS A 133 7.223 9.404 7.782 1.00 12.10 C ATOM 2000 CE LYS A 133 6.241 8.313 8.179 1.00 33.41 C ATOM 2001 NZ LYS A 133 6.778 7.454 9.271 1.00 73.44 N ATOM 0 H LYS A 133 5.036 12.989 9.886 1.00 24.15 H new ATOM 0 HA LYS A 133 5.871 10.246 9.709 1.00 3.14 H new ATOM 0 HB2 LYS A 133 5.810 12.523 8.056 1.00 73.21 H new ATOM 0 HB3 LYS A 133 7.518 12.228 8.317 1.00 73.21 H new ATOM 0 HG2 LYS A 133 5.468 10.402 7.054 1.00 40.31 H new ATOM 0 HG3 LYS A 133 6.967 11.000 6.370 1.00 40.31 H new ATOM 0 HD2 LYS A 133 7.884 9.033 6.999 1.00 12.10 H new ATOM 0 HD3 LYS A 133 7.851 9.658 8.636 1.00 12.10 H new ATOM 0 HE2 LYS A 133 5.304 8.767 8.502 1.00 33.41 H new ATOM 0 HE3 LYS A 133 6.013 7.696 7.310 1.00 33.41 H new ATOM 0 HZ1 LYS A 133 6.079 6.723 9.513 1.00 73.44 H new ATOM 0 HZ2 LYS A 133 7.659 7.000 8.954 1.00 73.44 H new ATOM 0 HZ3 LYS A 133 6.972 8.039 10.109 1.00 73.44 H new ATOM 2015 N GLU A 134 8.080 12.492 10.749 1.00 54.34 N ATOM 2016 CA GLU A 134 9.301 12.654 11.528 1.00 0.35 C ATOM 2017 C GLU A 134 9.423 14.080 12.058 1.00 2.30 C ATOM 2018 O GLU A 134 8.988 15.033 11.413 1.00 43.13 O ATOM 2019 CB GLU A 134 10.525 12.308 10.678 1.00 21.44 C ATOM 2020 CG GLU A 134 10.811 10.817 10.602 1.00 11.22 C ATOM 2021 CD GLU A 134 12.269 10.517 10.316 1.00 63.23 C ATOM 2022 OE1 GLU A 134 13.070 11.472 10.244 1.00 13.54 O ATOM 2023 OE2 GLU A 134 12.610 9.325 10.163 1.00 31.22 O ATOM 0 H GLU A 134 7.717 13.357 10.349 1.00 54.34 H new ATOM 0 HA GLU A 134 9.253 11.972 12.377 1.00 0.35 H new ATOM 0 HB2 GLU A 134 10.377 12.693 9.669 1.00 21.44 H new ATOM 0 HB3 GLU A 134 11.397 12.816 11.088 1.00 21.44 H new ATOM 0 HG2 GLU A 134 10.525 10.348 11.543 1.00 11.22 H new ATOM 0 HG3 GLU A 134 10.193 10.371 9.823 1.00 11.22 H new ATOM 2030 N GLY A 135 10.019 14.218 13.239 1.00 35.00 N ATOM 2031 CA GLY A 135 10.187 15.530 13.836 1.00 30.34 C ATOM 2032 C GLY A 135 9.073 15.873 14.806 1.00 63.32 C ATOM 2033 O GLY A 135 8.620 17.016 14.862 1.00 65.42 O ATOM 0 H GLY A 135 10.388 13.445 13.792 1.00 35.00 H new ATOM 0 HA2 GLY A 135 11.143 15.569 14.358 1.00 30.34 H new ATOM 0 HA3 GLY A 135 10.223 16.282 13.048 1.00 30.34 H new ATOM 2037 N MET A 136 8.630 14.880 15.570 1.00 14.11 N ATOM 2038 CA MET A 136 7.561 15.083 16.542 1.00 41.14 C ATOM 2039 C MET A 136 7.969 16.112 17.592 1.00 62.44 C ATOM 2040 O MET A 136 7.128 16.828 18.132 1.00 35.42 O ATOM 2041 CB MET A 136 7.201 13.760 17.220 1.00 62.22 C ATOM 2042 CG MET A 136 5.704 13.534 17.355 1.00 22.13 C ATOM 2043 SD MET A 136 4.927 14.693 18.498 1.00 64.43 S ATOM 2044 CE MET A 136 3.653 13.658 19.214 1.00 14.53 C ATOM 0 H MET A 136 8.994 13.928 15.535 1.00 14.11 H new ATOM 0 HA MET A 136 6.687 15.460 16.010 1.00 41.14 H new ATOM 0 HB2 MET A 136 7.634 12.939 16.649 1.00 62.22 H new ATOM 0 HB3 MET A 136 7.655 13.733 18.211 1.00 62.22 H new ATOM 0 HG2 MET A 136 5.236 13.628 16.375 1.00 22.13 H new ATOM 0 HG3 MET A 136 5.524 12.515 17.698 1.00 22.13 H new ATOM 0 HE1 MET A 136 3.028 14.256 19.877 1.00 14.53 H new ATOM 0 HE2 MET A 136 3.038 13.235 18.419 1.00 14.53 H new ATOM 0 HE3 MET A 136 4.116 12.851 19.782 1.00 14.53 H new ATOM 2054 N ASN A 137 9.266 16.179 17.875 1.00 30.42 N ATOM 2055 CA ASN A 137 9.785 17.119 18.861 1.00 10.35 C ATOM 2056 C ASN A 137 9.291 18.534 18.576 1.00 1.32 C ATOM 2057 O ASN A 137 8.993 19.296 19.497 1.00 62.12 O ATOM 2058 CB ASN A 137 11.315 17.092 18.867 1.00 52.41 C ATOM 2059 CG ASN A 137 11.895 17.487 20.211 1.00 22.12 C ATOM 2060 OD1 ASN A 137 12.697 16.755 20.792 1.00 11.44 O ATOM 2061 ND2 ASN A 137 11.491 18.649 20.712 1.00 63.40 N ATOM 0 H ASN A 137 9.976 15.594 17.435 1.00 30.42 H new ATOM 0 HA ASN A 137 9.420 16.816 19.842 1.00 10.35 H new ATOM 0 HB2 ASN A 137 11.659 16.091 18.606 1.00 52.41 H new ATOM 0 HB3 ASN A 137 11.691 17.769 18.099 1.00 52.41 H new ATOM 0 HD21 ASN A 137 11.847 18.967 21.613 1.00 63.40 H new ATOM 0 HD22 ASN A 137 10.825 19.223 20.195 1.00 63.40 H new ATOM 2068 N ILE A 138 9.206 18.879 17.296 1.00 65.43 N ATOM 2069 CA ILE A 138 8.747 20.201 16.889 1.00 21.14 C ATOM 2070 C ILE A 138 7.313 20.448 17.344 1.00 12.42 C ATOM 2071 O ILE A 138 6.963 21.554 17.758 1.00 62.02 O ATOM 2072 CB ILE A 138 8.828 20.380 15.362 1.00 55.12 C ATOM 2073 CG1 ILE A 138 10.276 20.248 14.886 1.00 11.45 C ATOM 2074 CG2 ILE A 138 8.251 21.728 14.956 1.00 45.34 C ATOM 2075 CD1 ILE A 138 11.239 21.149 15.628 1.00 63.14 C ATOM 0 H ILE A 138 9.449 18.261 16.522 1.00 65.43 H new ATOM 0 HA ILE A 138 9.407 20.925 17.366 1.00 21.14 H new ATOM 0 HB ILE A 138 8.238 19.596 14.887 1.00 55.12 H new ATOM 0 HG12 ILE A 138 10.596 19.213 15.003 1.00 11.45 H new ATOM 0 HG13 ILE A 138 10.323 20.478 13.821 1.00 11.45 H new ATOM 0 HG21 ILE A 138 8.315 21.840 13.874 1.00 45.34 H new ATOM 0 HG22 ILE A 138 7.207 21.785 15.265 1.00 45.34 H new ATOM 0 HG23 ILE A 138 8.816 22.526 15.438 1.00 45.34 H new ATOM 0 HD11 ILE A 138 12.247 21.003 15.239 1.00 63.14 H new ATOM 0 HD12 ILE A 138 10.944 22.189 15.490 1.00 63.14 H new ATOM 0 HD13 ILE A 138 11.221 20.905 16.690 1.00 63.14 H new ATOM 2087 N VAL A 139 6.486 19.411 17.267 1.00 72.44 N ATOM 2088 CA VAL A 139 5.089 19.514 17.673 1.00 24.10 C ATOM 2089 C VAL A 139 4.969 19.732 19.177 1.00 5.01 C ATOM 2090 O VAL A 139 3.974 20.272 19.658 1.00 71.00 O ATOM 2091 CB VAL A 139 4.297 18.252 17.284 1.00 73.04 C ATOM 2092 CG1 VAL A 139 2.899 18.293 17.883 1.00 62.12 C ATOM 2093 CG2 VAL A 139 4.233 18.109 15.770 1.00 10.15 C ATOM 0 H VAL A 139 6.759 18.489 16.927 1.00 72.44 H new ATOM 0 HA VAL A 139 4.670 20.373 17.149 1.00 24.10 H new ATOM 0 HB VAL A 139 4.814 17.381 17.687 1.00 73.04 H new ATOM 0 HG11 VAL A 139 2.354 17.393 17.597 1.00 62.12 H new ATOM 0 HG12 VAL A 139 2.970 18.345 18.969 1.00 62.12 H new ATOM 0 HG13 VAL A 139 2.370 19.171 17.512 1.00 62.12 H new ATOM 0 HG21 VAL A 139 3.670 17.212 15.513 1.00 10.15 H new ATOM 0 HG22 VAL A 139 3.740 18.982 15.343 1.00 10.15 H new ATOM 0 HG23 VAL A 139 5.243 18.030 15.369 1.00 10.15 H new ATOM 2103 N GLU A 140 5.992 19.309 19.914 1.00 35.33 N ATOM 2104 CA GLU A 140 6.000 19.458 21.365 1.00 72.12 C ATOM 2105 C GLU A 140 6.483 20.849 21.766 1.00 64.41 C ATOM 2106 O GLU A 140 6.100 21.373 22.811 1.00 55.43 O ATOM 2107 CB GLU A 140 6.892 18.392 22.004 1.00 35.34 C ATOM 2108 CG GLU A 140 6.525 16.972 21.605 1.00 42.20 C ATOM 2109 CD GLU A 140 5.898 16.190 22.742 1.00 34.32 C ATOM 2110 OE1 GLU A 140 6.393 16.302 23.883 1.00 24.20 O ATOM 2111 OE2 GLU A 140 4.912 15.466 22.492 1.00 72.53 O ATOM 0 H GLU A 140 6.824 18.861 19.531 1.00 35.33 H new ATOM 0 HA GLU A 140 4.979 19.329 21.724 1.00 72.12 H new ATOM 0 HB2 GLU A 140 7.928 18.582 21.725 1.00 35.34 H new ATOM 0 HB3 GLU A 140 6.832 18.483 23.089 1.00 35.34 H new ATOM 0 HG2 GLU A 140 5.832 17.003 20.764 1.00 42.20 H new ATOM 0 HG3 GLU A 140 7.420 16.452 21.262 1.00 42.20 H new ATOM 2118 N ALA A 141 7.329 21.439 20.928 1.00 51.13 N ATOM 2119 CA ALA A 141 7.864 22.769 21.193 1.00 23.42 C ATOM 2120 C ALA A 141 6.809 23.843 20.953 1.00 3.24 C ATOM 2121 O ALA A 141 6.723 24.819 21.699 1.00 71.51 O ATOM 2122 CB ALA A 141 9.089 23.027 20.328 1.00 23.44 C ATOM 0 H ALA A 141 7.659 21.017 20.060 1.00 51.13 H new ATOM 0 HA ALA A 141 8.157 22.813 22.242 1.00 23.42 H new ATOM 0 HB1 ALA A 141 9.478 24.024 20.536 1.00 23.44 H new ATOM 0 HB2 ALA A 141 9.855 22.284 20.551 1.00 23.44 H new ATOM 0 HB3 ALA A 141 8.813 22.958 19.276 1.00 23.44 H new ATOM 2128 N MET A 142 6.009 23.658 19.908 1.00 25.13 N ATOM 2129 CA MET A 142 4.960 24.612 19.571 1.00 14.33 C ATOM 2130 C MET A 142 3.979 24.772 20.728 1.00 14.44 C ATOM 2131 O MET A 142 3.702 25.888 21.169 1.00 23.51 O ATOM 2132 CB MET A 142 4.214 24.160 18.314 1.00 2.21 C ATOM 2133 CG MET A 142 4.976 24.428 17.026 1.00 24.55 C ATOM 2134 SD MET A 142 3.894 24.542 15.589 1.00 14.33 S ATOM 2135 CE MET A 142 2.924 23.048 15.776 1.00 70.12 C ATOM 0 H MET A 142 6.068 22.856 19.280 1.00 25.13 H new ATOM 0 HA MET A 142 5.429 25.577 19.379 1.00 14.33 H new ATOM 0 HB2 MET A 142 4.007 23.092 18.389 1.00 2.21 H new ATOM 0 HB3 MET A 142 3.251 24.669 18.270 1.00 2.21 H new ATOM 0 HG2 MET A 142 5.538 25.357 17.127 1.00 24.55 H new ATOM 0 HG3 MET A 142 5.703 23.632 16.866 1.00 24.55 H new ATOM 0 HE1 MET A 142 2.361 22.863 14.861 1.00 70.12 H new ATOM 0 HE2 MET A 142 3.588 22.205 15.970 1.00 70.12 H new ATOM 0 HE3 MET A 142 2.233 23.165 16.610 1.00 70.12 H new ATOM 2145 N GLU A 143 3.456 23.651 21.215 1.00 51.02 N ATOM 2146 CA GLU A 143 2.505 23.669 22.320 1.00 52.00 C ATOM 2147 C GLU A 143 3.075 24.426 23.516 1.00 54.41 C ATOM 2148 O GLU A 143 2.330 24.977 24.327 1.00 22.25 O ATOM 2149 CB GLU A 143 2.141 22.241 22.733 1.00 45.13 C ATOM 2150 CG GLU A 143 1.258 21.523 21.726 1.00 21.24 C ATOM 2151 CD GLU A 143 0.486 22.480 20.840 1.00 50.42 C ATOM 2152 OE1 GLU A 143 1.091 23.040 19.901 1.00 32.44 O ATOM 2153 OE2 GLU A 143 -0.724 22.670 21.085 1.00 41.12 O ATOM 0 H GLU A 143 3.675 22.719 20.862 1.00 51.02 H new ATOM 0 HA GLU A 143 1.605 24.182 21.982 1.00 52.00 H new ATOM 0 HB2 GLU A 143 3.057 21.668 22.874 1.00 45.13 H new ATOM 0 HB3 GLU A 143 1.631 22.269 23.696 1.00 45.13 H new ATOM 0 HG2 GLU A 143 1.876 20.876 21.103 1.00 21.24 H new ATOM 0 HG3 GLU A 143 0.557 20.880 22.257 1.00 21.24 H new ATOM 2160 N ARG A 144 4.399 24.449 23.618 1.00 45.02 N ATOM 2161 CA ARG A 144 5.070 25.137 24.715 1.00 72.32 C ATOM 2162 C ARG A 144 4.920 26.649 24.581 1.00 54.20 C ATOM 2163 O ARG A 144 4.998 27.381 25.568 1.00 43.22 O ATOM 2164 CB ARG A 144 6.552 24.762 24.750 1.00 65.22 C ATOM 2165 CG ARG A 144 7.480 25.910 24.386 1.00 33.20 C ATOM 2166 CD ARG A 144 7.807 26.767 25.599 1.00 42.14 C ATOM 2167 NE ARG A 144 9.243 26.991 25.739 1.00 45.33 N ATOM 2168 CZ ARG A 144 10.092 26.068 26.177 1.00 30.00 C ATOM 2169 NH1 ARG A 144 9.651 24.864 26.516 1.00 54.54 N ATOM 2170 NH2 ARG A 144 11.385 26.348 26.277 1.00 63.31 N ATOM 0 H ARG A 144 5.029 23.999 22.954 1.00 45.02 H new ATOM 0 HA ARG A 144 4.601 24.824 25.648 1.00 72.32 H new ATOM 0 HB2 ARG A 144 6.804 24.405 25.748 1.00 65.22 H new ATOM 0 HB3 ARG A 144 6.725 23.934 24.062 1.00 65.22 H new ATOM 0 HG2 ARG A 144 8.402 25.513 23.960 1.00 33.20 H new ATOM 0 HG3 ARG A 144 7.014 26.527 23.618 1.00 33.20 H new ATOM 0 HD2 ARG A 144 7.297 27.727 25.513 1.00 42.14 H new ATOM 0 HD3 ARG A 144 7.426 26.283 26.498 1.00 42.14 H new ATOM 0 HE ARG A 144 9.615 27.907 25.487 1.00 45.33 H new ATOM 0 HH11 ARG A 144 8.658 24.645 26.441 1.00 54.54 H new ATOM 0 HH12 ARG A 144 10.305 24.157 26.852 1.00 54.54 H new ATOM 0 HH21 ARG A 144 11.728 27.273 26.017 1.00 63.31 H new ATOM 0 HH22 ARG A 144 12.036 25.638 26.613 1.00 63.31 H new ATOM 2184 N PHE A 145 4.703 27.111 23.354 1.00 65.13 N ATOM 2185 CA PHE A 145 4.544 28.536 23.090 1.00 12.22 C ATOM 2186 C PHE A 145 3.091 28.869 22.762 1.00 2.35 C ATOM 2187 O PHE A 145 2.789 29.952 22.263 1.00 54.11 O ATOM 2188 CB PHE A 145 5.451 28.968 21.936 1.00 73.21 C ATOM 2189 CG PHE A 145 6.894 28.607 22.141 1.00 43.13 C ATOM 2190 CD1 PHE A 145 7.675 29.306 23.047 1.00 50.40 C ATOM 2191 CD2 PHE A 145 7.471 27.569 21.427 1.00 52.15 C ATOM 2192 CE1 PHE A 145 9.004 28.977 23.238 1.00 33.12 C ATOM 2193 CE2 PHE A 145 8.799 27.235 21.614 1.00 73.22 C ATOM 2194 CZ PHE A 145 9.566 27.940 22.520 1.00 44.33 C ATOM 0 H PHE A 145 4.633 26.519 22.527 1.00 65.13 H new ATOM 0 HA PHE A 145 4.830 29.081 23.990 1.00 12.22 H new ATOM 0 HB2 PHE A 145 5.097 28.507 21.014 1.00 73.21 H new ATOM 0 HB3 PHE A 145 5.370 30.047 21.805 1.00 73.21 H new ATOM 0 HD1 PHE A 145 7.240 30.118 23.611 1.00 50.40 H new ATOM 0 HD2 PHE A 145 6.876 27.015 20.716 1.00 52.15 H new ATOM 0 HE1 PHE A 145 9.602 29.530 23.947 1.00 33.12 H new ATOM 0 HE2 PHE A 145 9.236 26.423 21.052 1.00 73.22 H new ATOM 0 HZ PHE A 145 10.604 27.681 22.667 1.00 44.33 H new ATOM 2204 N GLY A 146 2.196 27.929 23.047 1.00 34.35 N ATOM 2205 CA GLY A 146 0.786 28.140 22.776 1.00 12.20 C ATOM 2206 C GLY A 146 -0.044 28.213 24.043 1.00 41.05 C ATOM 2207 O GLY A 146 0.434 27.876 25.126 1.00 52.22 O ATOM 0 H GLY A 146 2.422 27.025 23.461 1.00 34.35 H new ATOM 0 HA2 GLY A 146 0.662 29.064 22.211 1.00 12.20 H new ATOM 0 HA3 GLY A 146 0.415 27.330 22.148 1.00 12.20 H new ATOM 2211 N SER A 147 -1.290 28.656 23.907 1.00 20.52 N ATOM 2212 CA SER A 147 -2.186 28.777 25.051 1.00 75.11 C ATOM 2213 C SER A 147 -3.276 27.710 25.003 1.00 23.30 C ATOM 2214 O SER A 147 -3.888 27.479 23.960 1.00 30.53 O ATOM 2215 CB SER A 147 -2.821 30.169 25.083 1.00 72.43 C ATOM 2216 OG SER A 147 -1.953 31.138 24.522 1.00 1.13 O ATOM 0 H SER A 147 -1.701 28.937 23.017 1.00 20.52 H new ATOM 0 HA SER A 147 -1.599 28.632 25.958 1.00 75.11 H new ATOM 0 HB2 SER A 147 -3.761 30.156 24.532 1.00 72.43 H new ATOM 0 HB3 SER A 147 -3.058 30.441 26.112 1.00 72.43 H new ATOM 0 HG SER A 147 -2.382 32.018 24.553 1.00 1.13 H new ATOM 2222 N ARG A 148 -3.511 27.062 26.140 1.00 52.35 N ATOM 2223 CA ARG A 148 -4.525 26.018 26.228 1.00 12.52 C ATOM 2224 C ARG A 148 -5.879 26.533 25.747 1.00 43.11 C ATOM 2225 O ARG A 148 -6.744 25.754 25.349 1.00 1.30 O ATOM 2226 CB ARG A 148 -4.642 25.513 27.667 1.00 33.51 C ATOM 2227 CG ARG A 148 -3.344 24.950 28.222 1.00 32.53 C ATOM 2228 CD ARG A 148 -3.352 23.429 28.223 1.00 65.14 C ATOM 2229 NE ARG A 148 -4.162 22.886 29.310 1.00 64.34 N ATOM 2230 CZ ARG A 148 -3.775 22.876 30.580 1.00 24.33 C ATOM 2231 NH1 ARG A 148 -2.596 23.377 30.922 1.00 43.23 N ATOM 2232 NH2 ARG A 148 -4.568 22.364 31.513 1.00 62.33 N ATOM 0 H ARG A 148 -3.013 27.242 27.012 1.00 52.35 H new ATOM 0 HA ARG A 148 -4.219 25.194 25.584 1.00 12.52 H new ATOM 0 HB2 ARG A 148 -4.975 26.332 28.305 1.00 33.51 H new ATOM 0 HB3 ARG A 148 -5.411 24.742 27.711 1.00 33.51 H new ATOM 0 HG2 ARG A 148 -2.506 25.310 27.626 1.00 32.53 H new ATOM 0 HG3 ARG A 148 -3.193 25.315 29.238 1.00 32.53 H new ATOM 0 HD2 ARG A 148 -3.737 23.068 27.269 1.00 65.14 H new ATOM 0 HD3 ARG A 148 -2.330 23.061 28.314 1.00 65.14 H new ATOM 0 HE ARG A 148 -5.075 22.493 29.081 1.00 64.34 H new ATOM 0 HH11 ARG A 148 -1.983 23.772 30.208 1.00 43.23 H new ATOM 0 HH12 ARG A 148 -2.302 23.368 31.899 1.00 43.23 H new ATOM 0 HH21 ARG A 148 -5.476 21.978 31.255 1.00 62.33 H new ATOM 0 HH22 ARG A 148 -4.269 22.357 32.488 1.00 62.33 H new ATOM 2246 N ASN A 149 -6.054 27.850 25.787 1.00 23.01 N ATOM 2247 CA ASN A 149 -7.302 28.469 25.356 1.00 31.41 C ATOM 2248 C ASN A 149 -7.436 28.423 23.837 1.00 31.51 C ATOM 2249 O ASN A 149 -8.541 28.338 23.303 1.00 12.41 O ATOM 2250 CB ASN A 149 -7.372 29.918 25.842 1.00 65.13 C ATOM 2251 CG ASN A 149 -6.626 30.127 27.145 1.00 4.24 C ATOM 2252 OD1 ASN A 149 -5.393 30.613 27.050 1.00 54.32 O flip ATOM 2253 ND2 ASN A 149 -7.151 29.855 28.225 1.00 14.24 N flip ATOM 0 H ASN A 149 -5.347 28.509 26.114 1.00 23.01 H new ATOM 0 HA ASN A 149 -8.127 27.906 25.793 1.00 31.41 H new ATOM 0 HB2 ASN A 149 -6.955 30.575 25.079 1.00 65.13 H new ATOM 0 HB3 ASN A 149 -8.415 30.204 25.974 1.00 65.13 H new ATOM 0 HD21 ASN A 149 -8.101 29.484 28.251 1.00 14.24 H new ATOM 0 HD22 ASN A 149 -6.636 30.001 29.093 1.00 14.24 H new ATOM 2260 N GLY A 150 -6.301 28.478 23.146 1.00 33.22 N ATOM 2261 CA GLY A 150 -6.313 28.441 21.696 1.00 75.45 C ATOM 2262 C GLY A 150 -5.280 29.365 21.083 1.00 11.22 C ATOM 2263 O GLY A 150 -4.623 29.013 20.103 1.00 20.45 O ATOM 0 H GLY A 150 -5.374 28.548 23.565 1.00 33.22 H new ATOM 0 HA2 GLY A 150 -6.128 27.421 21.360 1.00 75.45 H new ATOM 0 HA3 GLY A 150 -7.304 28.720 21.337 1.00 75.45 H new ATOM 2267 N LYS A 151 -5.136 30.553 21.660 1.00 41.40 N ATOM 2268 CA LYS A 151 -4.176 31.533 21.166 1.00 63.04 C ATOM 2269 C LYS A 151 -2.746 31.032 21.344 1.00 72.41 C ATOM 2270 O LYS A 151 -2.522 29.912 21.806 1.00 14.22 O ATOM 2271 CB LYS A 151 -4.355 32.866 21.895 1.00 5.23 C ATOM 2272 CG LYS A 151 -4.402 34.067 20.966 1.00 71.30 C ATOM 2273 CD LYS A 151 -5.658 34.893 21.186 1.00 74.31 C ATOM 2274 CE LYS A 151 -5.633 35.598 22.533 1.00 21.02 C ATOM 2275 NZ LYS A 151 -7.003 35.936 23.008 1.00 32.45 N ATOM 0 H LYS A 151 -5.673 30.861 22.471 1.00 41.40 H new ATOM 0 HA LYS A 151 -4.361 31.680 20.102 1.00 63.04 H new ATOM 0 HB2 LYS A 151 -5.276 32.831 22.477 1.00 5.23 H new ATOM 0 HB3 LYS A 151 -3.536 32.996 22.602 1.00 5.23 H new ATOM 0 HG2 LYS A 151 -3.523 34.690 21.130 1.00 71.30 H new ATOM 0 HG3 LYS A 151 -4.365 33.729 19.930 1.00 71.30 H new ATOM 0 HD2 LYS A 151 -5.753 35.631 20.390 1.00 74.31 H new ATOM 0 HD3 LYS A 151 -6.534 34.247 21.128 1.00 74.31 H new ATOM 0 HE2 LYS A 151 -5.141 34.960 23.267 1.00 21.02 H new ATOM 0 HE3 LYS A 151 -5.041 36.510 22.455 1.00 21.02 H new ATOM 0 HZ1 LYS A 151 -6.943 36.415 23.929 1.00 32.45 H new ATOM 0 HZ2 LYS A 151 -7.464 36.565 22.320 1.00 32.45 H new ATOM 0 HZ3 LYS A 151 -7.561 35.064 23.107 1.00 32.45 H new ATOM 2289 N THR A 152 -1.780 31.868 20.976 1.00 72.54 N ATOM 2290 CA THR A 152 -0.373 31.509 21.095 1.00 4.22 C ATOM 2291 C THR A 152 0.479 32.729 21.425 1.00 2.55 C ATOM 2292 O THR A 152 0.066 33.867 21.198 1.00 22.43 O ATOM 2293 CB THR A 152 0.155 30.864 19.800 1.00 50.44 C ATOM 2294 OG1 THR A 152 0.372 31.871 18.805 1.00 71.15 O ATOM 2295 CG2 THR A 152 -0.825 29.827 19.274 1.00 72.25 C ATOM 0 H THR A 152 -1.947 32.799 20.593 1.00 72.54 H new ATOM 0 HA THR A 152 -0.299 30.786 21.908 1.00 4.22 H new ATOM 0 HB THR A 152 1.099 30.367 20.026 1.00 50.44 H new ATOM 0 HG1 THR A 152 1.328 32.078 18.752 1.00 71.15 H new ATOM 0 HG21 THR A 152 -0.431 29.385 18.359 1.00 72.25 H new ATOM 0 HG22 THR A 152 -0.966 29.047 20.022 1.00 72.25 H new ATOM 0 HG23 THR A 152 -1.782 30.305 19.063 1.00 72.25 H new ATOM 2303 N SER A 153 1.671 32.486 21.962 1.00 14.13 N ATOM 2304 CA SER A 153 2.580 33.566 22.327 1.00 51.23 C ATOM 2305 C SER A 153 3.352 34.061 21.108 1.00 65.44 C ATOM 2306 O SER A 153 3.287 35.237 20.751 1.00 12.20 O ATOM 2307 CB SER A 153 3.556 33.097 23.407 1.00 30.13 C ATOM 2308 OG SER A 153 4.824 33.710 23.251 1.00 52.25 O ATOM 0 H SER A 153 2.029 31.550 22.154 1.00 14.13 H new ATOM 0 HA SER A 153 1.985 34.391 22.719 1.00 51.23 H new ATOM 0 HB2 SER A 153 3.154 33.333 24.392 1.00 30.13 H new ATOM 0 HB3 SER A 153 3.664 32.013 23.358 1.00 30.13 H new ATOM 0 HG SER A 153 5.429 33.394 23.955 1.00 52.25 H new ATOM 2314 N LYS A 154 4.085 33.153 20.471 1.00 21.14 N ATOM 2315 CA LYS A 154 4.871 33.493 19.291 1.00 15.50 C ATOM 2316 C LYS A 154 4.046 33.317 18.020 1.00 43.33 C ATOM 2317 O LYS A 154 2.863 32.983 18.076 1.00 72.41 O ATOM 2318 CB LYS A 154 6.128 32.624 19.221 1.00 34.52 C ATOM 2319 CG LYS A 154 7.218 33.052 20.188 1.00 61.32 C ATOM 2320 CD LYS A 154 7.907 31.853 20.818 1.00 32.11 C ATOM 2321 CE LYS A 154 9.407 32.072 20.938 1.00 22.52 C ATOM 2322 NZ LYS A 154 9.900 31.794 22.316 1.00 53.00 N ATOM 0 H LYS A 154 4.151 32.175 20.753 1.00 21.14 H new ATOM 0 HA LYS A 154 5.166 34.539 19.370 1.00 15.50 H new ATOM 0 HB2 LYS A 154 5.856 31.589 19.428 1.00 34.52 H new ATOM 0 HB3 LYS A 154 6.523 32.652 18.206 1.00 34.52 H new ATOM 0 HG2 LYS A 154 7.954 33.661 19.662 1.00 61.32 H new ATOM 0 HG3 LYS A 154 6.787 33.677 20.970 1.00 61.32 H new ATOM 0 HD2 LYS A 154 7.485 31.667 21.806 1.00 32.11 H new ATOM 0 HD3 LYS A 154 7.715 30.964 20.217 1.00 32.11 H new ATOM 0 HE2 LYS A 154 9.926 31.426 20.230 1.00 22.52 H new ATOM 0 HE3 LYS A 154 9.647 33.100 20.667 1.00 22.52 H new ATOM 0 HZ1 LYS A 154 10.907 31.538 22.279 1.00 53.00 H new ATOM 0 HZ2 LYS A 154 9.780 32.642 22.905 1.00 53.00 H new ATOM 0 HZ3 LYS A 154 9.358 31.007 22.727 1.00 53.00 H new ATOM 2336 N LYS A 155 4.679 33.543 16.874 1.00 44.44 N ATOM 2337 CA LYS A 155 4.006 33.407 15.587 1.00 3.24 C ATOM 2338 C LYS A 155 4.568 32.226 14.802 1.00 54.31 C ATOM 2339 O LYS A 155 5.691 32.280 14.301 1.00 25.05 O ATOM 2340 CB LYS A 155 4.156 34.693 14.772 1.00 52.45 C ATOM 2341 CG LYS A 155 3.994 34.487 13.275 1.00 22.15 C ATOM 2342 CD LYS A 155 2.661 33.839 12.943 1.00 54.13 C ATOM 2343 CE LYS A 155 1.495 34.747 13.302 1.00 13.50 C ATOM 2344 NZ LYS A 155 1.447 35.958 12.435 1.00 31.44 N ATOM 0 H LYS A 155 5.658 33.821 16.810 1.00 44.44 H new ATOM 0 HA LYS A 155 2.948 33.225 15.775 1.00 3.24 H new ATOM 0 HB2 LYS A 155 3.416 35.418 15.113 1.00 52.45 H new ATOM 0 HB3 LYS A 155 5.138 35.124 14.967 1.00 52.45 H new ATOM 0 HG2 LYS A 155 4.070 35.447 12.764 1.00 22.15 H new ATOM 0 HG3 LYS A 155 4.806 33.862 12.903 1.00 22.15 H new ATOM 0 HD2 LYS A 155 2.625 33.602 11.880 1.00 54.13 H new ATOM 0 HD3 LYS A 155 2.569 32.896 13.483 1.00 54.13 H new ATOM 0 HE2 LYS A 155 0.561 34.194 13.205 1.00 13.50 H new ATOM 0 HE3 LYS A 155 1.579 35.051 14.345 1.00 13.50 H new ATOM 0 HZ1 LYS A 155 0.545 36.454 12.581 1.00 31.44 H new ATOM 0 HZ2 LYS A 155 2.234 36.592 12.680 1.00 31.44 H new ATOM 0 HZ3 LYS A 155 1.529 35.674 11.438 1.00 31.44 H new ATOM 2358 N ILE A 156 3.778 31.163 14.697 1.00 63.33 N ATOM 2359 CA ILE A 156 4.196 29.971 13.970 1.00 64.43 C ATOM 2360 C ILE A 156 3.914 30.109 12.478 1.00 42.55 C ATOM 2361 O ILE A 156 2.763 30.241 12.061 1.00 33.21 O ATOM 2362 CB ILE A 156 3.487 28.710 14.500 1.00 44.34 C ATOM 2363 CG1 ILE A 156 3.884 28.449 15.954 1.00 14.33 C ATOM 2364 CG2 ILE A 156 3.823 27.508 13.630 1.00 42.34 C ATOM 2365 CD1 ILE A 156 3.001 29.158 16.958 1.00 52.05 C ATOM 0 H ILE A 156 2.845 31.103 15.106 1.00 63.33 H new ATOM 0 HA ILE A 156 5.270 29.867 14.126 1.00 64.43 H new ATOM 0 HB ILE A 156 2.410 28.873 14.460 1.00 44.34 H new ATOM 0 HG12 ILE A 156 3.849 27.376 16.145 1.00 14.33 H new ATOM 0 HG13 ILE A 156 4.916 28.766 16.103 1.00 14.33 H new ATOM 0 HG21 ILE A 156 3.315 26.625 14.017 1.00 42.34 H new ATOM 0 HG22 ILE A 156 3.495 27.696 12.608 1.00 42.34 H new ATOM 0 HG23 ILE A 156 4.900 27.341 13.641 1.00 42.34 H new ATOM 0 HD11 ILE A 156 3.341 28.928 17.968 1.00 52.05 H new ATOM 0 HD12 ILE A 156 3.055 30.234 16.794 1.00 52.05 H new ATOM 0 HD13 ILE A 156 1.971 28.824 16.837 1.00 52.05 H new ATOM 2377 N THR A 157 4.974 30.078 11.675 1.00 74.11 N ATOM 2378 CA THR A 157 4.841 30.199 10.229 1.00 53.43 C ATOM 2379 C THR A 157 5.544 29.052 9.513 1.00 23.25 C ATOM 2380 O THR A 157 6.360 28.345 10.107 1.00 51.41 O ATOM 2381 CB THR A 157 5.417 31.535 9.722 1.00 55.21 C ATOM 2382 OG1 THR A 157 6.081 32.219 10.790 1.00 21.02 O ATOM 2383 CG2 THR A 157 4.316 32.419 9.155 1.00 74.43 C ATOM 0 H THR A 157 5.934 29.970 12.003 1.00 74.11 H new ATOM 0 HA THR A 157 3.775 30.163 10.006 1.00 53.43 H new ATOM 0 HB THR A 157 6.133 31.319 8.929 1.00 55.21 H new ATOM 0 HG1 THR A 157 6.446 33.066 10.459 1.00 21.02 H new ATOM 0 HG21 THR A 157 4.747 33.356 8.803 1.00 74.43 H new ATOM 0 HG22 THR A 157 3.831 31.908 8.323 1.00 74.43 H new ATOM 0 HG23 THR A 157 3.580 32.627 9.932 1.00 74.43 H new ATOM 2391 N ILE A 158 5.224 28.872 8.236 1.00 25.14 N ATOM 2392 CA ILE A 158 5.828 27.810 7.441 1.00 42.45 C ATOM 2393 C ILE A 158 6.931 28.358 6.541 1.00 62.52 C ATOM 2394 O ILE A 158 6.736 29.346 5.834 1.00 64.43 O ATOM 2395 CB ILE A 158 4.779 27.094 6.570 1.00 63.32 C ATOM 2396 CG1 ILE A 158 3.500 26.848 7.373 1.00 41.04 C ATOM 2397 CG2 ILE A 158 5.338 25.782 6.039 1.00 23.03 C ATOM 2398 CD1 ILE A 158 2.432 26.109 6.597 1.00 43.24 C ATOM 0 H ILE A 158 4.551 29.447 7.730 1.00 25.14 H new ATOM 0 HA ILE A 158 6.256 27.094 8.142 1.00 42.45 H new ATOM 0 HB ILE A 158 4.536 27.733 5.721 1.00 63.32 H new ATOM 0 HG12 ILE A 158 3.747 26.278 8.269 1.00 41.04 H new ATOM 0 HG13 ILE A 158 3.099 27.806 7.705 1.00 41.04 H new ATOM 0 HG21 ILE A 158 4.585 25.288 5.425 1.00 23.03 H new ATOM 0 HG22 ILE A 158 6.224 25.981 5.436 1.00 23.03 H new ATOM 0 HG23 ILE A 158 5.606 25.136 6.875 1.00 23.03 H new ATOM 0 HD11 ILE A 158 1.554 25.970 7.228 1.00 43.24 H new ATOM 0 HD12 ILE A 158 2.157 26.688 5.715 1.00 43.24 H new ATOM 0 HD13 ILE A 158 2.814 25.136 6.288 1.00 43.24 H new ATOM 2410 N ALA A 159 8.090 27.707 6.572 1.00 74.12 N ATOM 2411 CA ALA A 159 9.223 28.126 5.756 1.00 31.53 C ATOM 2412 C ALA A 159 9.192 27.454 4.387 1.00 10.25 C ATOM 2413 O ALA A 159 9.250 28.124 3.356 1.00 62.42 O ATOM 2414 CB ALA A 159 10.530 27.814 6.470 1.00 62.13 C ATOM 0 H ALA A 159 8.268 26.888 7.153 1.00 74.12 H new ATOM 0 HA ALA A 159 9.152 29.203 5.604 1.00 31.53 H new ATOM 0 HB1 ALA A 159 11.368 28.132 5.850 1.00 62.13 H new ATOM 0 HB2 ALA A 159 10.561 28.345 7.421 1.00 62.13 H new ATOM 0 HB3 ALA A 159 10.599 26.741 6.651 1.00 62.13 H new ATOM 2420 N ASP A 160 9.101 26.129 4.386 1.00 72.03 N ATOM 2421 CA ASP A 160 9.062 25.367 3.143 1.00 71.11 C ATOM 2422 C ASP A 160 8.223 24.103 3.307 1.00 44.04 C ATOM 2423 O ASP A 160 8.205 23.493 4.376 1.00 35.13 O ATOM 2424 CB ASP A 160 10.479 25.000 2.700 1.00 21.12 C ATOM 2425 CG ASP A 160 10.492 23.919 1.637 1.00 11.20 C ATOM 2426 OD1 ASP A 160 9.741 24.051 0.649 1.00 54.15 O ATOM 2427 OD2 ASP A 160 11.253 22.941 1.794 1.00 74.01 O ATOM 0 H ASP A 160 9.053 25.560 5.231 1.00 72.03 H new ATOM 0 HA ASP A 160 8.601 25.991 2.377 1.00 71.11 H new ATOM 0 HB2 ASP A 160 10.978 25.889 2.315 1.00 21.12 H new ATOM 0 HB3 ASP A 160 11.051 24.662 3.564 1.00 21.12 H new ATOM 2432 N CYS A 161 7.531 23.717 2.241 1.00 60.32 N ATOM 2433 CA CYS A 161 6.689 22.526 2.267 1.00 54.23 C ATOM 2434 C CYS A 161 6.612 21.884 0.885 1.00 14.43 C ATOM 2435 O CYS A 161 6.643 22.574 -0.133 1.00 65.43 O ATOM 2436 CB CYS A 161 5.284 22.881 2.757 1.00 71.42 C ATOM 2437 SG CYS A 161 4.860 24.630 2.581 1.00 62.41 S ATOM 0 H CYS A 161 7.536 24.211 1.349 1.00 60.32 H new ATOM 0 HA CYS A 161 7.136 21.809 2.956 1.00 54.23 H new ATOM 0 HB2 CYS A 161 4.557 22.285 2.205 1.00 71.42 H new ATOM 0 HB3 CYS A 161 5.195 22.601 3.807 1.00 71.42 H new ATOM 0 HG CYS A 161 3.653 24.830 3.020 1.00 62.41 H new ATOM 2443 N GLY A 162 6.512 20.559 0.859 1.00 73.32 N ATOM 2444 CA GLY A 162 6.434 19.846 -0.403 1.00 31.22 C ATOM 2445 C GLY A 162 6.556 18.345 -0.229 1.00 60.11 C ATOM 2446 O GLY A 162 7.026 17.870 0.805 1.00 53.23 O ATOM 0 H GLY A 162 6.484 19.966 1.689 1.00 73.32 H new ATOM 0 HA2 GLY A 162 5.486 20.077 -0.889 1.00 31.22 H new ATOM 0 HA3 GLY A 162 7.225 20.198 -1.065 1.00 31.22 H new ATOM 2450 N GLN A 163 6.131 17.597 -1.242 1.00 71.11 N ATOM 2451 CA GLN A 163 6.193 16.141 -1.195 1.00 21.12 C ATOM 2452 C GLN A 163 7.625 15.664 -0.977 1.00 3.11 C ATOM 2453 O GLN A 163 8.459 15.736 -1.881 1.00 2.34 O ATOM 2454 CB GLN A 163 5.635 15.543 -2.488 1.00 1.25 C ATOM 2455 CG GLN A 163 4.436 14.635 -2.270 1.00 20.42 C ATOM 2456 CD GLN A 163 4.103 13.804 -3.494 1.00 3.14 C ATOM 2457 OE1 GLN A 163 3.446 14.279 -4.420 1.00 71.22 O ATOM 2458 NE2 GLN A 163 4.557 12.556 -3.504 1.00 12.04 N ATOM 0 H GLN A 163 5.740 17.975 -2.105 1.00 71.11 H new ATOM 0 HA GLN A 163 5.585 15.804 -0.355 1.00 21.12 H new ATOM 0 HB2 GLN A 163 5.350 16.353 -3.160 1.00 1.25 H new ATOM 0 HB3 GLN A 163 6.422 14.978 -2.987 1.00 1.25 H new ATOM 0 HG2 GLN A 163 4.636 13.972 -1.428 1.00 20.42 H new ATOM 0 HG3 GLN A 163 3.571 15.241 -2.000 1.00 20.42 H new ATOM 0 HE21 GLN A 163 5.098 12.204 -2.714 1.00 12.04 H new ATOM 0 HE22 GLN A 163 4.365 11.950 -4.301 1.00 12.04 H new ATOM 2467 N LEU A 164 7.905 15.177 0.227 1.00 14.21 N ATOM 2468 CA LEU A 164 9.237 14.688 0.564 1.00 0.35 C ATOM 2469 C LEU A 164 9.752 13.730 -0.505 1.00 3.23 C ATOM 2470 O LEU A 164 10.832 13.928 -1.060 1.00 42.42 O ATOM 2471 CB LEU A 164 9.216 13.989 1.925 1.00 71.02 C ATOM 2472 CG LEU A 164 9.308 14.900 3.149 1.00 1.04 C ATOM 2473 CD1 LEU A 164 10.749 15.319 3.396 1.00 62.22 C ATOM 2474 CD2 LEU A 164 8.418 16.122 2.973 1.00 23.13 C ATOM 0 H LEU A 164 7.227 15.110 0.986 1.00 14.21 H new ATOM 0 HA LEU A 164 9.910 15.544 0.613 1.00 0.35 H new ATOM 0 HB2 LEU A 164 8.297 13.407 1.998 1.00 71.02 H new ATOM 0 HB3 LEU A 164 10.044 13.282 1.960 1.00 71.02 H new ATOM 0 HG LEU A 164 8.959 14.343 4.019 1.00 1.04 H new ATOM 0 HD11 LEU A 164 10.795 15.967 4.271 1.00 62.22 H new ATOM 0 HD12 LEU A 164 11.361 14.434 3.568 1.00 62.22 H new ATOM 0 HD13 LEU A 164 11.126 15.857 2.526 1.00 62.22 H new ATOM 0 HD21 LEU A 164 8.496 16.759 3.854 1.00 23.13 H new ATOM 0 HD22 LEU A 164 8.736 16.680 2.092 1.00 23.13 H new ATOM 0 HD23 LEU A 164 7.383 15.803 2.846 1.00 23.13 H new ATOM 2486 N GLU A 165 8.971 12.693 -0.789 1.00 20.34 N ATOM 2487 CA GLU A 165 9.349 11.705 -1.793 1.00 12.03 C ATOM 2488 C GLU A 165 9.752 12.384 -3.099 1.00 21.44 C ATOM 2489 O GLU A 165 9.927 11.698 -4.105 1.00 4.41 O ATOM 2490 CB GLU A 165 8.193 10.734 -2.045 1.00 44.22 C ATOM 2491 CG GLU A 165 8.575 9.274 -1.866 1.00 13.44 C ATOM 2492 CD GLU A 165 9.961 8.964 -2.395 1.00 42.24 C ATOM 2493 OE1 GLU A 165 10.112 8.843 -3.629 1.00 23.21 O ATOM 2494 OE2 GLU A 165 10.896 8.843 -1.575 1.00 55.24 O ATOM 0 H GLU A 165 8.073 12.515 -0.339 1.00 20.34 H new ATOM 0 HA GLU A 165 10.206 11.148 -1.414 1.00 12.03 H new ATOM 0 HB2 GLU A 165 7.374 10.973 -1.366 1.00 44.22 H new ATOM 0 HB3 GLU A 165 7.820 10.882 -3.058 1.00 44.22 H new ATOM 0 HG2 GLU A 165 8.529 9.017 -0.808 1.00 13.44 H new ATOM 0 HG3 GLU A 165 7.846 8.646 -2.378 1.00 13.44 H new